| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 28.9 | Very low | 36.7 | Very low | 226 Ų | 226 | 120.5 Ų | 120.5 | 100% | 1.113 | 67% | 0.667 | S | S | * | * | 0 | 116.6 | 0 | -87.6 | 175.4 | 169 | 0 | 0 | 105.9 | K3 | M1-K3 PolarHBondContact O-N 3.41Š| |||
| 2 | P | 33.5 | Very low | 37.3 | Very low | 75 Ų | 75 | 117.3 Ų | 117.3 | 49% | 0.487 | 64% | 0.642 | S | S | . | * | trans | -60.7 | 129.8 | 174.7 | -12.3 | 26.2 | 0 | 0 | 0 | 107.8 | T4 D28 | P2-T4 PolarHBondContact O-N 3.47Å; P2-D28 WeakPolarHBondContact CA-OD1 3.29Å; P2-D28 VanDerWaalsContact CB-OD1 3.31Å; P2-D28 WeakPolarHBondContact CB-OD1 3.17Å | ||
| 3 | K | 39.7 | Very low | 38.2 | Very low | 68 Ų | 68 | 113.4 Ų | 113.4 | 30% | 0.296 | 63% | 0.628 | S | S | . | * | trans | -78.2 | -5.7 | -177 | -83.3 | 179.1 | 169.3 | -176.1 | 0 | 113.7 | M1 K5 H87 E89 | M1-K3 PolarHBondContact O-N 3.41Å; K3-K5 PolarHBondContact O-N 3.2Å; K3-H87 PolarHBondContact NZ-O 3.12Å; K3-E89 HydrophobicContact CD-CG 4.5Å | ||
| 4 | T | 38.5 | Very low | 38.9 | Very low | 73 Ų | 73 | 117.2 Ų | 117.2 | 45% | 0.448 | 64% | 0.639 | S | S | . | * | trans | -72.2 | 93.8 | 177.9 | 48.8 | 0 | 0 | 0 | 0 | 110.7 | P2 I6 | P2-T4 PolarHBondContact O-N 3.47Å; T4-I6 PolarHBondContact O-N 2.78Å | ||
| 5 | K | 30.4 | Very low | 39.4 | Very low | 200 Ų | 200 | 118.3 Ų | 118.3 | 87% | 0.87 | 64% | 0.644 | S | S | * | * | trans | -62.7 | 102.1 | 156.4 | -87.8 | -176.8 | 176.3 | 175.5 | 0 | 107.6 | K3 V7 | K3-K5 PolarHBondContact O-N 3.2Å; K5-V7 PolarHBondContact O-N 2.93Å; K5-V7 VanDerWaalsContact O-N 3.15Å | ||
| 6 | I | 41.2 | Very low | 39.7 | Very low | 110 Ų | 110 | 115.4 Ų | 115.4 | 56% | 0.564 | 63% | 0.625 | S | S | * | * | trans | -62.5 | 112.5 | 164.7 | -51.9 | 169.6 | 0 | 0 | 0 | 105 | T4 E8 | T4-I6 PolarHBondContact O-N 2.78Å; I6-E8 PolarHBondContact O-N 2.97Å | ||
| 7 | V | 39.9 | Very low | 39.9 | Very low | 117 Ų | 117 | 116.6 Ų | 116.6 | 71% | 0.709 | 63% | 0.625 | S | S | * | * | trans | -61.5 | 119.4 | 165 | 175.9 | 0 | 0 | 0 | 0 | 105.4 | K5 S9 | K5-V7 PolarHBondContact O-N 2.93Å; K5-V7 VanDerWaalsContact O-N 3.15Å; V7-S9 PolarHBondContact O-N 3.39Å; V7-S9 PolarHBondContact O-OG 3.25Å | ||
| 8 | E | 34.2 | Very low | 39.8 | Very low | 194 Ų | 194 | 116.6 Ų | 116.6 | 91% | 0.907 | 62% | 0.624 | S | S | * | * | trans | -64.4 | 86.6 | 172.9 | -78.3 | -178.2 | 160 | 0 | 0 | 108.8 | I6 | I6-E8 PolarHBondContact O-N 2.97Š| ||
| 9 | S | 39.7 | Very low | 39.9 | Very low | 63 Ų | 63 | 113.1 Ų | 113.1 | 44% | 0.441 | 61% | 0.609 | S | S | . | * | trans | -77.6 | 142.1 | 158.7 | 0.6 | 0 | 0 | 0 | 0 | 108 | V7 F12 | V7-S9 PolarHBondContact O-N 3.39Å; V7-S9 PolarHBondContact O-OG 3.25Å; S9-F12 WeakPolarHBondContact OG-CE2 3.45Å; S9-F12 WeakPolarHBondContact OG-CZ 3.44Å | ||
| 10 | G | 38.6 | Very low | 40 | Very low | 56 Ų | 56 | 110.4 Ų | 110.4 | 58% | 0.577 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -55.1 | 179.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | F12 | G10-F12 PolarHBondContact O-N 3.08Š|
| 11 | P | 39.2 | Very low | 39.8 | Very low | 143 Ų | 143 | 112.4 Ų | 112.4 | 93% | 0.929 | 60% | 0.597 | S | S | * | * | trans | -56.6 | 105.1 | -165.1 | 24.8 | -33.8 | 0 | 0 | 0 | 111 | ||||
| 12 | F | 44.2 | Very low | 40.3 | Very low | 83 Ų | 83 | 109.9 Ų | 109.9 | 36% | 0.364 | 58% | 0.577 | S | S | . | * | trans | -75.3 | 147.3 | -179.4 | -84.2 | -60.6 | 0 | 0 | 0 | 110.4 | S9 G10 E16 I20 | S9-F12 WeakPolarHBondContact OG-CE2 3.45Å; S9-F12 WeakPolarHBondContact OG-CZ 3.44Å; G10-F12 PolarHBondContact O-N 3.08Å; F12-E16 HydrophobicContact CB-CB 3.73Å; F12-E16 HydrophobicContact CD1-CB 3.95Å; F12-E16 HydrophobicContact CD1-CG 4Å; F12-E16 WeakPolarHBondContact CD1-OE1 3.1Å; F12-E16 WeakPolarHBondContact CD1-OE2 3.27Å; F12-E16 HydrophobicContact CE1-CG 4.47Å; F12-E16 VanDerWaalsContact CE1-OE1 3.23Å; F12-E16 WeakPolarHBondContact CE1-OE1 3.23Å; F12-E16 HydrophobicContact CG-CB 4.02Å; F12-I20 HydrophobicContact CD2-CD1 3.8Å; F12-I20 HydrophobicContact CE2-CD1 3.96Å; F12-I20 HydrophobicContact CG-CD1 4.45Å | ||
| 13 | S | 48.4 | Very low | 40.7 | Very low | 66 Ų | 66 | 110 Ų | 110 | 46% | 0.462 | 57% | 0.568 | S | S | . | * | trans | -64.1 | 152.8 | 177.9 | 63 | 0 | 0 | 0 | 0 | 111 | N15 E16 E17 | S13-N15 PolarHBondContact O-N 3.04Å; S13-E16 PolarHBondContact N-OE2 2.82Å; S13-E16 WeakPolarHBondContact O-CA 3.34Å; S13-E16 WeakPolarHBondContact O-CB 3.06Å; S13-E16 PolarHBondContact O-N 2.89Å; S13-E16 PolarHBondContact OG-OE2 2.88Å; S13-E17 PolarHBondContact O-N 3.48Å | ||
| 14 | E | 48.5 | Very low | 41 | Very low | 167 Ų | 167 | 109.2 Ų | 109.2 | 78% | 0.78 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -49.3 | -27 | 180 | -88.9 | -179.1 | 142.9 | 0 | 0 | 114.1 | ||
| 15 | N | 46.7 | Very low | 41.3 | Very low | 134 Ų | 134 | 111.7 Ų | 111.7 | 72% | 0.717 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -76.5 | -24.7 | 176.6 | -77.4 | -31 | 0 | 0 | 0 | 114 | S13 | S13-N15 PolarHBondContact O-N 3.04Å |
| 16 | E | 43.9 | Very low | 42.3 | Very low | 72 Ų | 72 | 105.4 Ų | 105.4 | 34% | 0.336 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -81.6 | -31.6 | 173.7 | -83.3 | 161.2 | 135.8 | 0 | 0 | 111.9 | F12 S13 L18 C19 I20 | F12-E16 HydrophobicContact CB-CB 3.73Å; F12-E16 HydrophobicContact CD1-CB 3.95Å; F12-E16 HydrophobicContact CD1-CG 4Å; F12-E16 WeakPolarHBondContact CD1-OE1 3.1Å; F12-E16 WeakPolarHBondContact CD1-OE2 3.27Å; F12-E16 HydrophobicContact CE1-CG 4.47Å; F12-E16 VanDerWaalsContact CE1-OE1 3.23Å; F12-E16 WeakPolarHBondContact CE1-OE1 3.23Å; F12-E16 HydrophobicContact CG-CB 4.02Å; S13-E16 PolarHBondContact N-OE2 2.82Å; S13-E16 WeakPolarHBondContact O-CA 3.34Å; S13-E16 WeakPolarHBondContact O-CB 3.06Å; S13-E16 PolarHBondContact O-N 2.89Å; S13-E16 PolarHBondContact OG-OE2 2.88Å; E16-L18 VanDerWaalsContact C-N 3.32Å; E16-L18 PolarHBondContact O-N 3.14Å; E16-C19 CarbonylContact O-C 3.57Å; E16-C19 WeakPolarHBondContact O-CA 3.24Å; E16-C19 WeakPolarHBondContact O-CB 2.99Å; E16-C19 PolarHBondContact O-N 2.05Å; E16-I20 WeakPolarHBondContact O-CG1 3.4Å; E16-I20 PolarHBondContact O-N 3.16Å |
| 17 | E | 42.3 | Very low | 43 | Very low | 135 Ų | 135 | 101 Ų | 101 | 63% | 0.631 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -60.3 | -41.4 | 172.8 | -111.5 | -172.5 | 170.4 | 0 | 0 | 112 | S13 C19 I20 K21 | S13-E17 PolarHBondContact O-N 3.48Å; E17-C19 VanDerWaalsContact C-N 3.27Å; E17-C19 PolarHBondContact O-N 3.28Å; E17-I20 PolarHBondContact O-N 2.83Å; E17-K21 VanDerWaalsContact O-CB 3.28Å; E17-K21 WeakPolarHBondContact O-CB 3.3Å; E17-K21 PolarHBondContact O-N 2.82Å |
| 18 | L | 39.4 | Very low | 43.9 | Very low | 116 Ų | 116 | 99.2 Ų | 99.2 | 61% | 0.607 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.3 | -31.7 | 173.4 | -110.4 | 129 | 0 | 0 | 0 | 112.6 | E16 Y22 | E16-L18 VanDerWaalsContact C-N 3.32Å; E16-L18 PolarHBondContact O-N 3.14Å; L18-Y22 PolarHBondContact O-N 3.3Å |
| 19 | C | 40.4 | Very low | 45.9 | Very low | 50 Ų | 50 | 94.6 Ų | 94.6 | 34% | 0.338 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -72.5 | -43.9 | 176.6 | -147.2 | 0 | 0 | 0 | 0 | 110.7 | E16 E17 W23 | E16-C19 CarbonylContact O-C 3.57Å; E16-C19 WeakPolarHBondContact O-CA 3.24Å; E16-C19 WeakPolarHBondContact O-CB 2.99Å; E16-C19 PolarHBondContact O-N 2.05Å; E17-C19 VanDerWaalsContact C-N 3.27Å; E17-C19 PolarHBondContact O-N 3.28Å; C19-W23 PolarHBondContact O-N 2.99Å |
| 20 | I | 42.1 | Very low | 47.6 | Very low | 60 Ų | 60 | 93.3 Ų | 93.3 | 31% | 0.308 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -67.7 | -38 | 177.1 | -65.1 | 165.7 | 0 | 0 | 0 | 111.4 | F12 E16 E17 Y22 W23 C24 | F12-I20 HydrophobicContact CD2-CD1 3.8Å; F12-I20 HydrophobicContact CE2-CD1 3.96Å; F12-I20 HydrophobicContact CG-CD1 4.45Å; E16-I20 WeakPolarHBondContact O-CG1 3.4Å; E16-I20 PolarHBondContact O-N 3.16Å; E17-I20 PolarHBondContact O-N 2.83Å; I20-Y22 PolarHBondContact O-N 2.88Å; I20-W23 WeakPolarHBondContact O-CA 3.18Å; I20-W23 WeakPolarHBondContact O-CB 3.2Å; I20-W23 PolarHBondContact O-N 3.24Å; I20-C24 PolarHBondContact O-N 2.93Å |
| 21 | K | 37.2 | Very low | 49.6 | Very low | 153 Ų | 153 | 91.8 Ų | 91.8 | 67% | 0.665 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.6 | -38.2 | -179.9 | -164.4 | 170.8 | -174.6 | 173.4 | 0 | 113.1 | E17 W23 D25 | E17-K21 VanDerWaalsContact O-CB 3.28Å; E17-K21 WeakPolarHBondContact O-CB 3.3Å; E17-K21 PolarHBondContact O-N 2.82Å; K21-W23 PolarHBondContact O-N 3.39Å; K21-D25 PolarHBondContact O-N 3.24Å |
| 22 | Y | 37.7 | Very low | 51.8 | Low | 172 Ų | 172 | 90.7 Ų | 90.7 | 68% | 0.675 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -71.2 | -19.2 | 172 | -103.1 | -83.7 | 0 | 0 | 0 | 113.7 | L18 I20 | L18-Y22 PolarHBondContact O-N 3.3Å; I20-Y22 PolarHBondContact O-N 2.88Å |
| 23 | W | 43.5 | Very low | 54 | Low | 79 Ų | 79 | 89.2 Ų | 89.2 | 30% | 0.299 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -89.7 | -39.8 | -177.7 | -84.1 | 56.5 | 0 | 0 | 0 | 112.7 | C19 I20 K21 G27 K156 L157 Q160 | C19-W23 PolarHBondContact O-N 2.99Å; I20-W23 WeakPolarHBondContact O-CA 3.18Å; I20-W23 WeakPolarHBondContact O-CB 3.2Å; I20-W23 PolarHBondContact O-N 3.24Å; K21-W23 PolarHBondContact O-N 3.39Å; W23-G27 PolarHBondContact O-N 2.9Å; W23-K156 HydrophobicContact CH2-CB 3.97Å; W23-K156 HydrophobicContact CZ2-CB 3.72Å; W23-K156 HydrophobicContact CZ2-CD 4.37Å; W23-K156 HydrophobicContact CZ2-CG 4.47Å; W23-L157 HydrophobicContact CH2-CD2 4.26Å; W23-L157 HydrophobicContact CZ3-CD2 4.34Å; W23-Q160 HydrophobicContact CH2-CG 4Å; W23-Q160 HydrophobicContact CZ2-CG 4.02Å; W23-Q160 VanDerWaalsContact CZ3-NE2 3.35Å |
| 24 | C | 44.3 | Very low | 55.9 | Low | 51 Ų | 51 | 86 Ų | 86 | 35% | 0.345 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -74.7 | -36.4 | 178.7 | -70.7 | 0 | 0 | 0 | 0 | 112.9 | I20 N26 | I20-C24 PolarHBondContact O-N 2.93Å; C24-N26 VanDerWaalsContact C-N 3.29Å; C24-N26 PolarHBondContact O-N 2.99Å |
| 25 | D | 45.6 | Very low | 57.9 | Low | 125 Ų | 125 | 79.9 Ų | 79.9 | 67% | 0.668 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -74 | -16.7 | -177.9 | -102.1 | -8.7 | 0 | 0 | 0 | 113.9 | K21 | K21-D25 PolarHBondContact O-N 3.24Å |
| 26 | N | 52.4 | Low | 60.2 | Low | 67 Ų | 67 | 76.7 Ų | 76.7 | 36% | 0.358 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -109.7 | -5.8 | 178.6 | -82.6 | -42 | 0 | 0 | 0 | 114.6 | C24 N29 W30 | C24-N26 VanDerWaalsContact C-N 3.29Å; C24-N26 PolarHBondContact O-N 2.99Å; N26-N29 PolarHBondContact O-N 2.99Å; N26-N29 PolarHBondContact OD1-ND2 2.96Å; N26-N29 VanDerWaalsContact OD1-ND2 3.09Å; N26-W30 PolarHBondContact O-N 3.19Å |
| 27 | G | 54.3 | Low | 62.6 | Low | 17 Ų | 17 | 73.5 Ų | 73.5 | 18% | 0.175 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -60.1 | -46.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | W23 N29 W30 D31 | W23-G27 PolarHBondContact O-N 2.9Å; G27-N29 VanDerWaalsContact C-N 3.25Å; G27-N29 PolarHBondContact O-N 3.47Å; G27-W30 PolarHBondContact O-N 3.06Å; G27-W30 VanDerWaalsContact O-N 3.08Å; G27-D31 PolarHBondContact O-N 3.39Å |
| 28 | D | 59.3 | Low | 65.1 | Low | 81 Ų | 81 | 67 Ų | 67 | 43% | 0.433 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -60.1 | -36 | 176.3 | -78.7 | -12.5 | 0 | 0 | 0 | 112 | P2 F32 | P2-D28 WeakPolarHBondContact CA-OD1 3.29Å; P2-D28 VanDerWaalsContact CB-OD1 3.31Å; P2-D28 WeakPolarHBondContact CB-OD1 3.17Å; D28-F32 WeakPolarHBondContact O-CB 3.32Å; D28-F32 PolarHBondContact O-N 3.5Å |
| 29 | N | 75.3 | Confident | 67.8 | Low | 96 Ų | 96 | 65.3 Ų | 65.3 | 51% | 0.513 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -69.6 | -35.9 | 177.1 | -70.5 | -29.6 | 0 | 0 | 0 | 112 | N26 G27 F33 | N26-N29 PolarHBondContact O-N 2.99Å; N26-N29 PolarHBondContact OD1-ND2 2.96Å; N26-N29 VanDerWaalsContact OD1-ND2 3.09Å; G27-N29 VanDerWaalsContact C-N 3.25Å; G27-N29 PolarHBondContact O-N 3.47Å; N29-F33 WeakPolarHBondContact O-CB 3.46Å; N29-F33 PolarHBondContact O-N 3.23Å |
| 30 | W | 77.1 | Confident | 70.5 | Confident | 36 Ų | 36 | 66.2 Ų | 66.2 | 14% | 0.136 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -72.3 | -46.1 | 177.7 | 177.6 | 80.8 | 0 | 0 | 0 | 112.1 | N26 G27 F32 F33 T34 L85 P92 M97 E153 | N26-W30 PolarHBondContact O-N 3.19Å; G27-W30 PolarHBondContact O-N 3.06Å; G27-W30 VanDerWaalsContact O-N 3.08Å; W30-F32 VanDerWaalsContact C-N 3.31Å; W30-F32 PolarHBondContact O-N 3.34Å; W30-F33 PolarHBondContact O-N 2.93Å; W30-T34 HydrophobicContact CD2-CG2 4.23Å; W30-T34 HydrophobicContact CZ2-CG2 3.84Å; W30-T34 PolarHBondContact O-N 2.86Å; W30-T34 PolarHBondContact O-OG1 3.48Å; W30-L85 HydrophobicContact CH2-CB 4.23Å; W30-L85 HydrophobicContact CH2-CD2 4.34Å; W30-L85 HydrophobicContact CZ2-CB 4.49Å; W30-L85 HydrophobicContact CZ2-CD2 4.39Å; W30-P92 HydrophobicContact CH2-CG 4.06Å; W30-M97 HydrophobicContact CZ2-CE 4.45Å; W30-E153 HydrophobicContact CG-CG 4.24Å |
| 31 | D | 80.3 | Confident | 73.1 | Confident | 24 Ų | 24 | 63.3 Ų | 63.3 | 13% | 0.128 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.5 | -46.7 | 176.3 | -78.5 | -15.9 | 0 | 0 | 0 | 110.3 | G27 T34 M35 Y86 | G27-D31 PolarHBondContact O-N 3.39Å; D31-T34 PolarHBondContact O-OG1 3.49Å; D31-M35 VanDerWaalsContact O-CB 3.31Å; D31-M35 WeakPolarHBondContact O-CB 3.01Å; D31-M35 PolarHBondContact O-N 3.22Å; D31-Y86 HydrophobicContact CB-CD2 4.03Å; D31-Y86 HydrophobicContact CB-CE2 4.24Å; D31-Y86 VanDerWaalsContact O-CD2 3.31Å; D31-Y86 WeakPolarHBondContact O-CD2 3.34Å |
| 32 | F | 85.5 | Confident | 75.9 | Confident | 120 Ų | 120 | 57.9 Ų | 57.9 | 53% | 0.526 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -66.4 | -40.4 | 179 | -171.4 | -110.8 | 0 | 0 | 0 | 112.4 | D28 W30 M35 I36 | D28-F32 WeakPolarHBondContact O-CB 3.32Å; D28-F32 PolarHBondContact O-N 3.5Å; W30-F32 VanDerWaalsContact C-N 3.31Å; W30-F32 PolarHBondContact O-N 3.34Å; F32-M35 HydrophobicContact CD2-CE 3.55Å; F32-M35 HydrophobicContact CE2-CE 3.66Å; F32-M35 PolarHBondContact O-N 3.08Å; F32-I36 HydrophobicContact CD1-CD1 3.67Å; F32-I36 HydrophobicContact CD1-CG1 4.47Å; F32-I36 HydrophobicContact CE1-CD1 3.16Å; F32-I36 HydrophobicContact CE1-CG1 4.22Å; F32-I36 HydrophobicContact CE2-CD1 4.11Å; F32-I36 HydrophobicContact CE2-CG1 4.46Å; F32-I36 HydrophobicContact CG-CD1 4.35Å; F32-I36 HydrophobicContact CZ-CD1 3.42Å; F32-I36 VanDerWaalsContact CZ-CD1 3.42Å; F32-I36 HydrophobicContact CZ-CG1 4.22Å; F32-I36 WeakPolarHBondContact O-CG1 3.31Å; F32-I36 PolarHBondContact O-N 3.2Å |
| 33 | F | 88.9 | Confident | 78.8 | Confident | 52 Ų | 52 | 53.3 Ų | 53.3 | 23% | 0.228 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64 | -45.6 | 177.4 | 171 | -98.7 | 0 | 0 | 0 | 112.3 | N29 W30 I36 T37 V145 H146 F149 | N29-F33 WeakPolarHBondContact O-CB 3.46Å; N29-F33 PolarHBondContact O-N 3.23Å; W30-F33 PolarHBondContact O-N 2.93Å; F33-I36 PolarHBondContact O-N 3.41Å; F33-T37 VanDerWaalsContact O-CB 3.3Å; F33-T37 WeakPolarHBondContact O-CB 3Å; F33-T37 PolarHBondContact O-N 3.49Å; F33-T37 PolarHBondContact O-OG1 2.98Å; F33-V145 HydrophobicContact CE2-CG1 3.99Å; F33-V145 HydrophobicContact CZ-CG1 3.77Å; F33-H146 AromaticContact CE1-CD2 3.79Å; F33-F149 HydrophobicContact CD1-CB 4.34Å; F33-F149 HydrophobicContact CD1-CG 4.5Å; F33-F149 HydrophobicContact CE1-CB 3.86Å; F33-F149 HydrophobicContact CE1-CD2 4.05Å; F33-F149 HydrophobicContact CE1-CG 4.11Å; F33-F149 HydrophobicContact CE2-CD2 4.5Å; F33-F149 AromaticContact CZ-CD2 3.96Å; F33-F149 HydrophobicContact CZ-CD2 3.96Å; F33-F149 HydrophobicContact CZ-CG 4.48Å |
| 34 | T | 89.4 | Confident | 81.3 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.6 | -39 | 178.7 | 48.4 | 0 | 0 | 0 | 0 | 111.2 | W30 D31 T37 G38 | W30-T34 HydrophobicContact CD2-CG2 4.23Å; W30-T34 HydrophobicContact CZ2-CG2 3.84Å; W30-T34 PolarHBondContact O-N 2.86Å; W30-T34 PolarHBondContact O-OG1 3.48Å; D31-T34 PolarHBondContact O-OG1 3.49Å; T34-T37 PolarHBondContact O-N 3.04Å; T34-G38 PolarHBondContact O-N 3.21Å |
| 35 | M | 91.2 | Very high | 83.8 | Confident | 38 Ų | 38 | 48.8 Ų | 48.8 | 19% | 0.187 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.7 | -51.2 | 173.1 | -175.3 | -168.2 | 68.7 | 0 | 0 | 112.5 | D31 F32 T37 G38 L39 M83 Y86 | D31-M35 VanDerWaalsContact O-CB 3.31Å; D31-M35 WeakPolarHBondContact O-CB 3.01Å; D31-M35 PolarHBondContact O-N 3.22Å; F32-M35 HydrophobicContact CD2-CE 3.55Å; F32-M35 HydrophobicContact CE2-CE 3.66Å; F32-M35 PolarHBondContact O-N 3.08Å; M35-T37 VanDerWaalsContact C-N 3.32Å; M35-T37 PolarHBondContact O-N 3.14Å; M35-G38 PolarHBondContact O-N 3.02Å; M35-L39 HydrophobicContact CG-CD1 4.25Å; M35-L39 PolarHBondContact O-N 2.73Å; M35-M83 HydrophobicContact CG-CE 4.13Å; M35-M83 HydrophobicContact CG-SD 4.09Å; M35-M83 VanDerWaalsContact O-SD 3.37Å; M35-Y86 HydrophobicContact CB-CD1 4.23Å; M35-Y86 HydrophobicContact CB-CD2 3.79Å; M35-Y86 HydrophobicContact CB-CE2 4.2Å; M35-Y86 HydrophobicContact CB-CG 3.79Å; M35-Y86 HydrophobicContact CG-CD1 4.08Å; M35-Y86 HydrophobicContact CG-CD2 4.36Å; M35-Y86 HydrophobicContact CG-CE1 4.19Å; M35-Y86 HydrophobicContact CG-CE2 4.46Å; M35-Y86 HydrophobicContact CG-CG 4.16Å; M35-Y86 HydrophobicContact SD-CD1 4.5Å; M35-Y86 HydrophobicContact SD-CE1 4.01Å; M35-Y86 HydrophobicContact SD-CE2 4.12Å |
| 36 | I | 93.9 | Very high | 86.2 | Confident | 66 Ų | 66 | 47.1 Ų | 47.1 | 34% | 0.338 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -60.3 | -46.3 | 178.2 | -75.2 | 179.7 | 0 | 0 | 0 | 110.5 | F32 F33 G38 L39 L40 | F32-I36 HydrophobicContact CD1-CD1 3.67Å; F32-I36 HydrophobicContact CD1-CG1 4.47Å; F32-I36 HydrophobicContact CE1-CD1 3.16Å; F32-I36 HydrophobicContact CE1-CG1 4.22Å; F32-I36 HydrophobicContact CE2-CD1 4.11Å; F32-I36 HydrophobicContact CE2-CG1 4.46Å; F32-I36 HydrophobicContact CG-CD1 4.35Å; F32-I36 HydrophobicContact CZ-CD1 3.42Å; F32-I36 VanDerWaalsContact CZ-CD1 3.42Å; F32-I36 HydrophobicContact CZ-CG1 4.22Å; F32-I36 WeakPolarHBondContact O-CG1 3.31Å; F32-I36 PolarHBondContact O-N 3.2Å; F33-I36 PolarHBondContact O-N 3.41Å; I36-G38 VanDerWaalsContact C-N 3.33Å; I36-G38 PolarHBondContact O-N 2.85Å; I36-L39 PolarHBondContact O-N 3.5Å; I36-L40 HydrophobicContact CG2-CD1 3.86Å; I36-L40 HydrophobicContact CG2-CG 4.33Å; I36-L40 WeakPolarHBondContact O-CG 3.47Å; I36-L40 PolarHBondContact O-N 2.81Å |
| 37 | T | 94.3 | Very high | 88.3 | Confident | 5 Ų | 5 | 49.1 Ų | 49.1 | 3% | 0.031 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.3 | -47.3 | 179.4 | -56.8 | 0 | 0 | 0 | 0 | 110.5 | F33 T34 M35 L39 L40 L41 I142 H146 | F33-T37 VanDerWaalsContact O-CB 3.3Å; F33-T37 WeakPolarHBondContact O-CB 3Å; F33-T37 PolarHBondContact O-N 3.49Å; F33-T37 PolarHBondContact O-OG1 2.98Å; T34-T37 PolarHBondContact O-N 3.04Å; M35-T37 VanDerWaalsContact C-N 3.32Å; M35-T37 PolarHBondContact O-N 3.14Å; T37-L39 PolarHBondContact O-N 3.45Å; T37-L40 PolarHBondContact O-N 3.39Å; T37-L41 HydrophobicContact CG2-CD1 3.8Å; T37-L41 HydrophobicContact CG2-CG 4.34Å; T37-L41 WeakPolarHBondContact O-CB 3.29Å; T37-L41 VanDerWaalsContact O-CG 3.25Å; T37-L41 WeakPolarHBondContact O-CG 3.4Å; T37-L41 PolarHBondContact O-N 2.72Å; T37-I142 HydrophobicContact CG2-CG2 3.45Å; T37-I142 VanDerWaalsContact CG2-CG2 3.45Å; T37-H146 HydrophobicContact CG2-CB 3.8Å |
| 38 | G | 94.7 | Very high | 90.2 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -57.7 | -47.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | T34 M35 I36 L40 L41 L42 | T34-G38 PolarHBondContact O-N 3.21Å; M35-G38 PolarHBondContact O-N 3.02Å; I36-G38 VanDerWaalsContact C-N 3.33Å; I36-G38 PolarHBondContact O-N 2.85Å; G38-L40 PolarHBondContact O-N 3.14Å; G38-L41 PolarHBondContact O-N 3.04Å; G38-L42 WeakPolarHBondContact O-CB 3.48Å; G38-L42 VanDerWaalsContact O-CG 3.25Å; G38-L42 WeakPolarHBondContact O-CG 3.39Å; G38-L42 PolarHBondContact O-N 2.64Å |
| 39 | L | 96.5 | Very high | 91.9 | Very high | 79 Ų | 79 | 45.7 Ų | 45.7 | 41% | 0.414 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -60.4 | -45.4 | 176.6 | -80.4 | 166.3 | 0 | 0 | 0 | 112.7 | M35 I36 T37 L41 L42 I43 M83 | M35-L39 HydrophobicContact CG-CD1 4.25Å; M35-L39 PolarHBondContact O-N 2.73Å; I36-L39 PolarHBondContact O-N 3.5Å; T37-L39 PolarHBondContact O-N 3.45Å; L39-L41 PolarHBondContact O-N 3.02Å; L39-L42 PolarHBondContact O-N 2.92Å; L39-I43 WeakPolarHBondContact O-CB 3.4Å; L39-I43 VanDerWaalsContact O-CG1 3.25Å; L39-I43 WeakPolarHBondContact O-CG1 3.36Å; L39-I43 PolarHBondContact O-N 3.2Å; L39-M83 HydrophobicContact CG-CE 4.45Å; L39-M83 HydrophobicContact CG-SD 4Å |
| 40 | L | 96.9 | Very high | 92.9 | Very high | 69 Ų | 69 | 46.4 Ų | 46.4 | 36% | 0.361 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -61.7 | -44.9 | 177.8 | -74 | 173.4 | 0 | 0 | 0 | 111.4 | I36 T37 G38 L42 I43 M44 I142 | I36-L40 HydrophobicContact CG2-CD1 3.86Å; I36-L40 HydrophobicContact CG2-CG 4.33Å; I36-L40 WeakPolarHBondContact O-CG 3.47Å; I36-L40 PolarHBondContact O-N 2.81Å; T37-L40 PolarHBondContact O-N 3.39Å; G38-L40 PolarHBondContact O-N 3.14Å; L40-L42 PolarHBondContact O-N 3.27Å; L40-I43 PolarHBondContact O-N 3.03Å; L40-M44 WeakPolarHBondContact O-CB 3.41Å; L40-M44 WeakPolarHBondContact O-CG 3.37Å; L40-M44 PolarHBondContact O-N 3.36Å; L40-I142 HydrophobicContact CB-CD1 4.3Å; L40-I142 HydrophobicContact CD1-CD1 4.29Å |
| 41 | L | 96.5 | Very high | 93.6 | Very high | 0 Ų | 0 | 45.9 Ų | 45.9 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -63 | -41.4 | 178.2 | -69.2 | 170.1 | 0 | 0 | 0 | 111.8 | T37 G38 L39 M44 G45 I78 V139 I142 | T37-L41 HydrophobicContact CG2-CD1 3.8Å; T37-L41 HydrophobicContact CG2-CG 4.34Å; T37-L41 WeakPolarHBondContact O-CB 3.29Å; T37-L41 VanDerWaalsContact O-CG 3.25Å; T37-L41 WeakPolarHBondContact O-CG 3.4Å; T37-L41 PolarHBondContact O-N 2.72Å; G38-L41 PolarHBondContact O-N 3.04Å; L39-L41 PolarHBondContact O-N 3.02Å; L41-M44 PolarHBondContact O-N 3.43Å; L41-G45 PolarHBondContact O-N 2.88Å; L41-I78 HydrophobicContact CB-CG1 4.5Å; L41-I78 HydrophobicContact CD1-CB 4.47Å; L41-I78 HydrophobicContact CD1-CD1 4.01Å; L41-I78 HydrophobicContact CD1-CG1 3.98Å; L41-I78 HydrophobicContact CD2-CD1 3.82Å; L41-I78 HydrophobicContact CD2-CG1 4.36Å; L41-I78 HydrophobicContact CG-CD1 4.42Å; L41-V139 HydrophobicContact CD2-CB 4.41Å; L41-V139 HydrophobicContact CD2-CG1 3.72Å; L41-V139 HydrophobicContact CD2-CG2 4.21Å; L41-I142 HydrophobicContact CD2-CG2 4.11Å; L41-I142 HydrophobicContact CG-CG2 4.22Å |
| 42 | L | 97.2 | Very high | 94.1 | Very high | 38 Ų | 38 | 44.8 Ų | 44.8 | 20% | 0.199 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.1 | -48.2 | 174.4 | -71.6 | 172.2 | 0 | 0 | 0 | 111.7 | G38 L39 L40 M44 G45 L46 L76 T80 M83 | G38-L42 WeakPolarHBondContact O-CB 3.48Å; G38-L42 VanDerWaalsContact O-CG 3.25Å; G38-L42 WeakPolarHBondContact O-CG 3.39Å; G38-L42 PolarHBondContact O-N 2.64Å; L39-L42 PolarHBondContact O-N 2.92Å; L40-L42 PolarHBondContact O-N 3.27Å; L42-M44 PolarHBondContact O-N 3.35Å; L42-G45 PolarHBondContact O-N 3.44Å; L42-L46 WeakPolarHBondContact O-CG 3.45Å; L42-L46 PolarHBondContact O-N 2.86Å; L42-L76 HydrophobicContact CD2-CD2 3.91Å; L42-T80 HydrophobicContact CD2-CG2 3.82Å; L42-M83 HydrophobicContact CD1-CG 3.9Å |
| 43 | I | 97.3 | Very high | 94.5 | Very high | 77 Ų | 77 | 42.1 Ų | 42.1 | 40% | 0.395 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -61.5 | -46.2 | 179.5 | -71.3 | 166.8 | 0 | 0 | 0 | 110.6 | L39 L40 G45 L46 F47 | L39-I43 WeakPolarHBondContact O-CB 3.4Å; L39-I43 VanDerWaalsContact O-CG1 3.25Å; L39-I43 WeakPolarHBondContact O-CG1 3.36Å; L39-I43 PolarHBondContact O-N 3.2Å; L40-I43 PolarHBondContact O-N 3.03Å; I43-G45 VanDerWaalsContact C-N 3.35Å; I43-G45 PolarHBondContact O-N 3.32Å; I43-L46 PolarHBondContact O-N 3.33Å; I43-F47 HydrophobicContact CG2-CD2 3.61Å; I43-F47 HydrophobicContact CG2-CE2 3.41Å; I43-F47 VanDerWaalsContact CG2-CE2 3.41Å; I43-F47 WeakPolarHBondContact O-CD2 3.17Å; I43-F47 PolarHBondContact O-N 3.38Å |
| 44 | M | 96.7 | Very high | 94.6 | Very high | 35 Ų | 35 | 41.4 Ų | 41.4 | 17% | 0.172 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -62.7 | -41.6 | 177.9 | -70.6 | -61.4 | 178.3 | 0 | 0 | 111.8 | L40 L41 L42 F47 C48 I135 L138 V139 | L40-M44 WeakPolarHBondContact O-CB 3.41Å; L40-M44 WeakPolarHBondContact O-CG 3.37Å; L40-M44 PolarHBondContact O-N 3.36Å; L41-M44 PolarHBondContact O-N 3.43Å; L42-M44 PolarHBondContact O-N 3.35Å; M44-F47 PolarHBondContact O-N 3.19Å; M44-C48 PolarHBondContact O-N 3Å; M44-I135 HydrophobicContact CB-CG2 3.81Å; M44-I135 HydrophobicContact CG-CG2 4.27Å; M44-I135 HydrophobicContact SD-CG1 4.16Å; M44-I135 HydrophobicContact SD-CG2 3.91Å; M44-L138 HydrophobicContact CE-CD1 4.01Å; M44-V139 HydrophobicContact CB-CG2 3.84Å; M44-V139 HydrophobicContact CG-CG2 4.2Å |
| 45 | G | 96.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59.7 | -45.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L41 L42 I43 C48 S49 S72 | L41-G45 PolarHBondContact O-N 2.88Å; L42-G45 PolarHBondContact O-N 3.44Å; I43-G45 VanDerWaalsContact C-N 3.35Å; I43-G45 PolarHBondContact O-N 3.32Å; G45-C48 PolarHBondContact O-N 3.39Å; G45-S49 PolarHBondContact O-N 3.08Å; G45-S49 VanDerWaalsContact O-N 3.08Å; G45-S72 WeakPolarHBondContact O-CB 3.42Å; G45-S72 PolarHBondContact O-OG 3.25Å |
| 46 | L | 96.7 | Very high | 94.6 | Very high | 90 Ų | 90 | 43.2 Ų | 43.2 | 47% | 0.471 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -62.2 | -44.5 | 176.3 | -71.7 | 173.5 | 0 | 0 | 0 | 111.7 | L42 I43 C48 S49 I50 L76 | L42-L46 WeakPolarHBondContact O-CG 3.45Å; L42-L46 PolarHBondContact O-N 2.86Å; I43-L46 PolarHBondContact O-N 3.33Å; L46-C48 VanDerWaalsContact C-N 3.34Å; L46-C48 PolarHBondContact O-N 2.89Å; L46-S49 PolarHBondContact O-N 3.12Å; L46-S49 VanDerWaalsContact O-N 3.11Å; L46-S49 PolarHBondContact O-OG 2.81Å; L46-I50 WeakPolarHBondContact O-CG1 3.31Å; L46-I50 PolarHBondContact O-N 2.89Å; L46-L76 HydrophobicContact CD2-CD2 4.22Å; L46-L76 HydrophobicContact CG-CD2 4.09Å |
| 47 | F | 95.8 | Very high | 94.6 | Very high | 109 Ų | 109 | 45.7 Ų | 45.7 | 48% | 0.478 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -58.1 | -44.9 | 175.8 | -84.3 | -62.5 | 0 | 0 | 0 | 112.3 | I43 M44 S49 I50 I51 I135 | I43-F47 HydrophobicContact CG2-CD2 3.61Å; I43-F47 HydrophobicContact CG2-CE2 3.41Å; I43-F47 VanDerWaalsContact CG2-CE2 3.41Å; I43-F47 WeakPolarHBondContact O-CD2 3.17Å; I43-F47 PolarHBondContact O-N 3.38Å; M44-F47 PolarHBondContact O-N 3.19Å; F47-S49 VanDerWaalsContact C-N 3.3Å; F47-S49 PolarHBondContact O-N 2.99Å; F47-I50 PolarHBondContact O-N 3.16Å; F47-I51 WeakPolarHBondContact O-CB 3.38Å; F47-I51 WeakPolarHBondContact O-CD1 3.47Å; F47-I51 VanDerWaalsContact O-CG1 3.25Å; F47-I51 WeakPolarHBondContact O-CG1 3.37Å; F47-I51 PolarHBondContact O-N 3.31Å; F47-I135 HydrophobicContact CB-CD1 3.93Å |
| 48 | C | 94.5 | Very high | 94.4 | Very high | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.9 | -40.8 | 174.9 | -78.7 | 0 | 0 | 0 | 0 | 112.3 | M44 G45 L46 E52 I135 | M44-C48 PolarHBondContact O-N 3Å; G45-C48 PolarHBondContact O-N 3.39Å; L46-C48 VanDerWaalsContact C-N 3.34Å; L46-C48 PolarHBondContact O-N 2.89Å; C48-E52 PolarHBondContact O-N 3.49Å; C48-E52 VanDerWaalsContact O-N 3.12Å; C48-I135 VanDerWaalsContact SG-CG2 3.53Å |
| 49 | S | 95 | Very high | 94.1 | Very high | 25 Ų | 25 | 56.8 Ų | 56.8 | 18% | 0.175 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -65.4 | -44.3 | 176.6 | 76 | 0 | 0 | 0 | 0 | 112.4 | G45 L46 F47 I51 E52 V53 S72 | G45-S49 PolarHBondContact O-N 3.08Å; G45-S49 VanDerWaalsContact O-N 3.08Å; L46-S49 PolarHBondContact O-N 3.12Å; L46-S49 VanDerWaalsContact O-N 3.11Å; L46-S49 PolarHBondContact O-OG 2.81Å; F47-S49 VanDerWaalsContact C-N 3.3Å; F47-S49 PolarHBondContact O-N 2.99Å; S49-I51 VanDerWaalsContact C-N 3.32Å; S49-I51 PolarHBondContact O-N 3.02Å; S49-E52 PolarHBondContact O-N 3.36Å; S49-V53 VanDerWaalsContact O-CB 3.25Å; S49-V53 WeakPolarHBondContact O-CB 3.23Å; S49-V53 VanDerWaalsContact O-CG2 3.23Å; S49-V53 WeakPolarHBondContact O-CG2 3.25Å; S49-V53 PolarHBondContact O-N 3.09Å; S49-S72 WeakPolarHBondContact CB-OG 3.28Å |
| 50 | I | 94.9 | Very high | 93.7 | Very high | 111 Ų | 111 | 62.7 Ų | 62.7 | 57% | 0.569 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -64.6 | -41.7 | -177.6 | -69.4 | 166.6 | 0 | 0 | 0 | 109.8 | L46 F47 G54 | L46-I50 WeakPolarHBondContact O-CG1 3.31Å; L46-I50 PolarHBondContact O-N 2.89Å; F47-I50 PolarHBondContact O-N 3.16Å; I50-G54 WeakPolarHBondContact O-CA 3.4Å; I50-G54 PolarHBondContact O-N 3.43Å |
| 51 | I | 92.3 | Very high | 93.2 | Very high | 26 Ų | 26 | 68 Ų | 68 | 13% | 0.133 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.8 | -51.2 | 177.3 | -69.1 | 166.2 | 0 | 0 | 0 | 110.4 | F47 S49 Y55 L128 L131 I132 I135 | F47-I51 WeakPolarHBondContact O-CB 3.38Å; F47-I51 WeakPolarHBondContact O-CD1 3.47Å; F47-I51 VanDerWaalsContact O-CG1 3.25Å; F47-I51 WeakPolarHBondContact O-CG1 3.37Å; F47-I51 PolarHBondContact O-N 3.31Å; S49-I51 VanDerWaalsContact C-N 3.32Å; S49-I51 PolarHBondContact O-N 3.02Å; I51-Y55 WeakPolarHBondContact O-CB 3.42Å; I51-Y55 PolarHBondContact O-N 2.96Å; I51-L128 HydrophobicContact CG2-CB 3.85Å; I51-L128 HydrophobicContact CG2-CD2 3.99Å; I51-L128 HydrophobicContact CG2-CG 4.43Å; I51-L131 HydrophobicContact CD1-CB 3.95Å; I51-L131 HydrophobicContact CD1-CD1 4.39Å; I51-I132 HydrophobicContact CG2-CD1 3.88Å; I51-I132 HydrophobicContact CG2-CG1 3.95Å; I51-I135 HydrophobicContact CD1-CD1 4.04Å |
| 52 | E | 92 | Very high | 92.7 | Very high | 1 Ų | 1 | 73.6 Ų | 73.6 | 1% | 0.005 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -70.4 | -46 | -175.6 | -163.4 | 75.5 | -152.9 | 0 | 0 | 111.7 | C48 S49 Y55 I56 C66 G68 L69 Y129 I132 | C48-E52 PolarHBondContact O-N 3.49Å; C48-E52 VanDerWaalsContact O-N 3.12Å; S49-E52 PolarHBondContact O-N 3.36Å; E52-Y55 WeakPolarHBondContact O-CB 3.24Å; E52-Y55 PolarHBondContact O-N 3.22Å; E52-I56 HydrophobicContact CG-CD1 4.22Å; E52-I56 VanDerWaalsContact O-CG1 3.29Å; E52-I56 WeakPolarHBondContact O-CG1 3.23Å; E52-I56 PolarHBondContact O-N 3.41Å; E52-C66 WeakPolarHBondContact OE1-CA 3.47Å; E52-G68 WeakPolarHBondContact OE2-CA 3.42Å; E52-G68 PolarHBondContact OE2-N 3.41Å; E52-L69 HydrophobicContact CB-CG 4.11Å; E52-L69 HydrophobicContact CG-CB 4.45Å; E52-L69 HydrophobicContact CG-CD1 4.16Å; E52-L69 HydrophobicContact CG-CG 3.84Å; E52-Y129 PolarHBondContact OE1-OH 2.9Å; E52-I132 WeakPolarHBondContact OE2-CD1 3.41Å |
| 53 | V | 93.7 | Very high | 91.9 | Very high | 63 Ų | 63 | 74.6 Ų | 74.6 | 38% | 0.382 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -64.6 | -42.9 | 177.7 | 175.1 | 0 | 0 | 0 | 0 | 110.7 | S49 Y55 I56 L57 L69 | S49-V53 VanDerWaalsContact O-CB 3.25Å; S49-V53 WeakPolarHBondContact O-CB 3.23Å; S49-V53 VanDerWaalsContact O-CG2 3.23Å; S49-V53 WeakPolarHBondContact O-CG2 3.25Å; S49-V53 PolarHBondContact O-N 3.09Å; V53-Y55 VanDerWaalsContact C-N 3.28Å; V53-Y55 PolarHBondContact O-N 3.1Å; V53-I56 PolarHBondContact O-N 3.37Å; V53-L57 HydrophobicContact CG1-CD1 3.93Å; V53-L57 HydrophobicContact CG1-CG 4.26Å; V53-L57 WeakPolarHBondContact O-CB 3.43Å; V53-L57 VanDerWaalsContact O-CG 3.32Å; V53-L57 WeakPolarHBondContact O-CG 3.39Å; V53-L57 PolarHBondContact O-N 2.97Å; V53-L69 HydrophobicContact CG2-CD2 3.92Å |
| 54 | G | 91.5 | Very high | 91.3 | Very high | 38 Ų | 38 | 71.3 Ų | 71.3 | 39% | 0.392 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -59.3 | -40.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | I50 Y58 | I50-G54 WeakPolarHBondContact O-CA 3.4Å; I50-G54 PolarHBondContact O-N 3.43Å; G54-Y58 VanDerWaalsContact O-CB 3.31Å; G54-Y58 WeakPolarHBondContact O-CB 3.13Å; G54-Y58 PolarHBondContact O-N 2.96Å |
| 55 | Y | 89.1 | Confident | 90.9 | Very high | 32 Ų | 32 | 78.3 Ų | 78.3 | 13% | 0.125 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -65.6 | -44.5 | 175.2 | -174.1 | -99.3 | 0 | 0 | 0 | 112.8 | I51 E52 V53 Y58 T59 Q63 L128 | I51-Y55 WeakPolarHBondContact O-CB 3.42Å; I51-Y55 PolarHBondContact O-N 2.96Å; E52-Y55 WeakPolarHBondContact O-CB 3.24Å; E52-Y55 PolarHBondContact O-N 3.22Å; V53-Y55 VanDerWaalsContact C-N 3.28Å; V53-Y55 PolarHBondContact O-N 3.1Å; Y55-Y58 PolarHBondContact O-N 3.49Å; Y55-T59 HydrophobicContact CD2-CG2 4.15Å; Y55-T59 HydrophobicContact CE1-CG2 4.13Å; Y55-T59 WeakPolarHBondContact CE1-OG1 3.08Å; Y55-T59 HydrophobicContact CE2-CG2 3.66Å; Y55-T59 PolarHBondContact O-N 3.19Å; Y55-T59 PolarHBondContact O-OG1 3.28Å; Y55-Q63 HydrophobicContact CE1-CB 3.94Å; Y55-Q63 HydrophobicContact CE1-CG 3.85Å; Y55-Q63 PolarHBondContact OH-NE2 2.95Å; Y55-Q63 VanDerWaalsContact OH-NE2 3.14Å; Y55-Q63 PolarHBondContact OH-OE1 3.08Å; Y55-L128 HydrophobicContact CD2-CD1 3.39Å; Y55-L128 HydrophobicContact CE2-CD1 4.19Å; Y55-L128 HydrophobicContact CG-CD1 4.15Å |
| 56 | I | 91.3 | Very high | 90.5 | Very high | 43 Ų | 43 | 79.6 Ų | 79.6 | 22% | 0.221 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -62.2 | -44.7 | 177.8 | -68.5 | 164.5 | 0 | 0 | 0 | 110.2 | E52 V53 Y58 Y60 L69 | E52-I56 HydrophobicContact CG-CD1 4.22Å; E52-I56 VanDerWaalsContact O-CG1 3.29Å; E52-I56 WeakPolarHBondContact O-CG1 3.23Å; E52-I56 PolarHBondContact O-N 3.41Å; V53-I56 PolarHBondContact O-N 3.37Å; I56-Y58 VanDerWaalsContact C-N 3.33Å; I56-Y58 PolarHBondContact O-N 2.67Å; I56-Y60 WeakPolarHBondContact O-CA 3.21Å; I56-Y60 PolarHBondContact O-N 3.25Å; I56-L69 HydrophobicContact CD1-CD1 3.97Å |
| 57 | L | 93.1 | Very high | 90.3 | Very high | 119 Ų | 119 | 75.3 Ų | 75.3 | 62% | 0.623 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -65.4 | -36.1 | 178.1 | -70.7 | 174.4 | 0 | 0 | 0 | 112.3 | V53 | V53-L57 HydrophobicContact CG1-CD1 3.93Å; V53-L57 HydrophobicContact CG1-CG 4.26Å; V53-L57 WeakPolarHBondContact O-CB 3.43Å; V53-L57 VanDerWaalsContact O-CG 3.32Å; V53-L57 WeakPolarHBondContact O-CG 3.39Å; V53-L57 PolarHBondContact O-N 2.97Å |
| 58 | Y | 89.9 | Confident | 90.1 | Very high | 199 Ų | 199 | 70.1 Ų | 70.1 | 78% | 0.78 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -73.2 | -40.6 | 179.2 | -179.5 | -111.6 | 0 | 0 | 0 | 112.8 | G54 Y55 I56 | G54-Y58 VanDerWaalsContact O-CB 3.31Å; G54-Y58 WeakPolarHBondContact O-CB 3.13Å; G54-Y58 PolarHBondContact O-N 2.96Å; Y55-Y58 PolarHBondContact O-N 3.49Å; I56-Y58 VanDerWaalsContact C-N 3.33Å; I56-Y58 PolarHBondContact O-N 2.67Å |
| 59 | T | 88.9 | Confident | 90.1 | Very high | 38 Ų | 38 | 73.3 Ų | 73.3 | 23% | 0.233 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -104.8 | -11.5 | -172 | 63.6 | 0 | 0 | 0 | 0 | 114.9 | Y55 R61 | Y55-T59 HydrophobicContact CD2-CG2 4.15Å; Y55-T59 HydrophobicContact CE1-CG2 4.13Å; Y55-T59 WeakPolarHBondContact CE1-OG1 3.08Å; Y55-T59 HydrophobicContact CE2-CG2 3.66Å; Y55-T59 PolarHBondContact O-N 3.19Å; Y55-T59 PolarHBondContact O-OG1 3.28Å; T59-R61 PolarHBondContact O-N 3.22Å; T59-R61 PolarHBondContact OG1-N 2.99Å |
| 60 | Y | 88.6 | Confident | 90 | Very high | 203 Ų | 203 | 76.4 Ų | 76.4 | 80% | 0.796 | 36% | 0.355 | S | S | * | . | S | Bend | trans | 53.1 | 27.5 | -169.5 | -65.8 | -91.3 | 0 | 0 | 0 | 113.6 | I56 | I56-Y60 WeakPolarHBondContact O-CA 3.21Å; I56-Y60 PolarHBondContact O-N 3.25Å |
| 61 | R | 85.7 | Confident | 90 | Very high | 181 Ų | 181 | 71.1 Ų | 71.1 | 68% | 0.683 | 33% | 0.328 | S | S | * | . | trans | -133.5 | 143.3 | -178.7 | -68.7 | -176.3 | -177.6 | -168.8 | 0.8 | 111.4 | T59 | T59-R61 PolarHBondContact O-N 3.22Å; T59-R61 PolarHBondContact OG1-N 2.99Å | ||
| 62 | I | 84.7 | Confident | 90.2 | Very high | 117 Ų | 117 | 70.1 Ų | 70.1 | 60% | 0.6 | 32% | 0.323 | S | S | * | . | trans | -85 | 128.9 | 166.5 | -69.2 | 168.9 | 0 | 0 | 0 | 107.8 | C66 | I62-C66 HydrophobicContact CG2-CB 4.46Å; I62-C66 WeakPolarHBondContact CG2-SG 3.41Å | ||
| 63 | Q | 81.1 | Confident | 90.4 | Very high | 59 Ų | 59 | 73 Ų | 73 | 28% | 0.276 | 35% | 0.347 | S | S | . | . | trans | -122.2 | 156.5 | 172.8 | -82.2 | -167.2 | -9.3 | 0 | 0 | 111.3 | Y55 Y65 C66 Y129 | Y55-Q63 HydrophobicContact CE1-CB 3.94Å; Y55-Q63 HydrophobicContact CE1-CG 3.85Å; Y55-Q63 PolarHBondContact OH-NE2 2.95Å; Y55-Q63 VanDerWaalsContact OH-NE2 3.14Å; Y55-Q63 PolarHBondContact OH-OE1 3.08Å; Q63-Y65 PolarHBondContact O-N 2.83Å; Q63-C66 PolarHBondContact O-N 3.22Å; Q63-Y129 HydrophobicContact CB-CE2 4.11Å; Q63-Y129 WeakPolarHBondContact CB-OH 3.25Å; Q63-Y129 PolarHBondContact O-OH 3.35Å; Q63-Y129 VanDerWaalsContact O-OH 3.08Å | ||
| 64 | C | 84.8 | Confident | 90.5 | Very high | 8 Ų | 8 | 70.1 Ų | 70.1 | 5% | 0.054 | 33% | 0.331 | C | S | . | . | G | 310 helix | trans | 44.8 | 44.7 | 175.2 | -54.5 | 0 | 0 | 0 | 0 | 114.4 | C66 V67 C122 Y129 | C64-C66 PolarHBondContact O-N 2.85Å; C64-V67 WeakPolarHBondContact O-CB 3.5Å; C64-V67 PolarHBondContact O-N 2.88Å; C64-C122 WeakPolarHBondContact CA-SG 3.4Å; C64-C122 HydrophobicContact CB-CB 3.77Å; C64-C122 WeakPolarHBondContact CB-SG 3.25Å; C64-C122 VanDerWaalsContact SG-C 3.53Å; C64-C122 WeakPolarHBondContact SG-CB 3.35Å; C64-C122 CovalentContact SG-SG 2.05Å; C64-C122 PolarHBondContact SG-SG 3.45Å; C64-Y129 HydrophobicContact CB-CE1 3.85Å; C64-Y129 HydrophobicContact CB-CE2 4.22Å; C64-Y129 VanDerWaalsContact SG-CE2 3.58Å |
| 65 | Y | 87.7 | Confident | 90.8 | Very high | 182 Ų | 182 | 68.3 Ų | 68.3 | 71% | 0.714 | 31% | 0.312 | S | S | * | . | G | 310 helix | trans | 58.4 | 32.7 | 177.1 | -48.6 | -81.3 | 0 | 0 | 0 | 113.9 | Q63 V67 F118 | Q63-Y65 PolarHBondContact O-N 2.83Å; Y65-V67 VanDerWaalsContact C-N 3.3Å; Y65-V67 PolarHBondContact O-N 3.43Å; Y65-F118 AromaticContact CD2-CD1 3.99Å; Y65-F118 HydrophobicContact CD2-CD1 3.99Å; Y65-F118 HydrophobicContact CD2-CE1 4.19Å; Y65-F118 HydrophobicContact CE2-CD1 4.08Å; Y65-F118 HydrophobicContact CE2-CE1 4.1Å |
| 66 | C | 89.4 | Confident | 91.2 | Very high | 27 Ų | 27 | 69.2 Ų | 69.2 | 18% | 0.182 | 32% | 0.319 | C | S | . | . | G | 310 helix | trans | 56.5 | 40.6 | -177 | -72.6 | 0 | 0 | 0 | 0 | 112.5 | E52 I62 Q63 C64 G68 L69 W70 | E52-C66 WeakPolarHBondContact OE1-CA 3.47Å; I62-C66 HydrophobicContact CG2-CB 4.46Å; I62-C66 WeakPolarHBondContact CG2-SG 3.41Å; Q63-C66 PolarHBondContact O-N 3.22Å; C64-C66 PolarHBondContact O-N 2.85Å; C66-G68 PolarHBondContact O-N 3.11Å; C66-L69 HydrophobicContact CB-CB 4.27Å; C66-L69 HydrophobicContact CB-CD1 4.18Å; C66-L69 PolarHBondContact O-N 3.39Å; C66-W70 VanDerWaalsContact O-CD1 3.31Å |
| 67 | V | 91.9 | Very high | 91.5 | Very high | 1 Ų | 1 | 70.5 Ų | 70.5 | 1% | 0.006 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -59.4 | -34.7 | -160.6 | 79.3 | 0 | 0 | 0 | 0 | 113.4 | C64 Y65 L69 W70 C71 A115 F118 T119 Y129 I132 | C64-V67 WeakPolarHBondContact O-CB 3.5Å; C64-V67 PolarHBondContact O-N 2.88Å; Y65-V67 VanDerWaalsContact C-N 3.3Å; Y65-V67 PolarHBondContact O-N 3.43Å; V67-L69 PolarHBondContact O-N 3.43Å; V67-W70 VanDerWaalsContact C-CD1 3.47Å; V67-W70 VanDerWaalsContact CA-CD1 3.41Å; V67-W70 HydrophobicContact CG2-CZ2 3.81Å; V67-W70 PolarHBondContact O-NE1 3.19Å; V67-C71 WeakPolarHBondContact O-CB 3.29Å; V67-C71 PolarHBondContact O-N 3.02Å; V67-C71 PolarHBondContact O-SG 2.7Å; V67-C71 VanDerWaalsContact O-SG 3.39Å; V67-A115 HydrophobicContact CG2-CB 3.76Å; V67-F118 HydrophobicContact CG2-CB 4.35Å; V67-T119 HydrophobicContact CB-CG2 4.47Å; V67-T119 HydrophobicContact CG1-CG2 3.43Å; V67-T119 VanDerWaalsContact CG1-CG2 3.43Å; V67-T119 HydrophobicContact CG2-CG2 4.36Å; V67-Y129 HydrophobicContact CG1-CD1 3.93Å; V67-Y129 HydrophobicContact CG1-CE1 3.74Å; V67-I132 HydrophobicContact CG1-CD1 4.43Å; V67-I132 HydrophobicContact CG1-CG2 4.18Å |
| 68 | G | 92.1 | Very high | 91.7 | Very high | 0 Ų | 0 | 64.9 Ų | 64.9 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -66.7 | -32.1 | 177 | 0 | 0 | 0 | 0 | 0 | 113.9 | E52 C66 S72 | E52-G68 WeakPolarHBondContact OE2-CA 3.42Å; E52-G68 PolarHBondContact OE2-N 3.41Å; C66-G68 PolarHBondContact O-N 3.11Å; G68-S72 WeakPolarHBondContact O-CB 3.45Å; G68-S72 PolarHBondContact O-N 2.87Å |
| 69 | L | 93.4 | Very high | 92 | Very high | 66 Ų | 66 | 55.4 Ų | 55.4 | 35% | 0.346 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -73 | -48.8 | -176.3 | -83.6 | 168.4 | 0 | 0 | 0 | 112.8 | E52 V53 I56 C66 V67 S72 A73 | E52-L69 HydrophobicContact CB-CG 4.11Å; E52-L69 HydrophobicContact CG-CB 4.45Å; E52-L69 HydrophobicContact CG-CD1 4.16Å; E52-L69 HydrophobicContact CG-CG 3.84Å; V53-L69 HydrophobicContact CG2-CD2 3.92Å; I56-L69 HydrophobicContact CD1-CD1 3.97Å; C66-L69 HydrophobicContact CB-CB 4.27Å; C66-L69 HydrophobicContact CB-CD1 4.18Å; C66-L69 PolarHBondContact O-N 3.39Å; V67-L69 PolarHBondContact O-N 3.43Å; L69-S72 WeakPolarHBondContact O-CB 3.4Å; L69-S72 PolarHBondContact O-N 3.18Å; L69-A73 PolarHBondContact O-N 3.33Å |
| 70 | W | 93.9 | Very high | 92.3 | Very high | 90 Ų | 90 | 57.2 Ų | 57.2 | 34% | 0.341 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -67.9 | -41.4 | 177.8 | 68.6 | -56.9 | 0 | 0 | 0 | 110.7 | C66 V67 S72 A73 G74 M111 I114 A115 | C66-W70 VanDerWaalsContact O-CD1 3.31Å; V67-W70 VanDerWaalsContact C-CD1 3.47Å; V67-W70 VanDerWaalsContact CA-CD1 3.41Å; V67-W70 HydrophobicContact CG2-CZ2 3.81Å; V67-W70 PolarHBondContact O-NE1 3.19Å; W70-S72 VanDerWaalsContact C-N 3.31Å; W70-S72 PolarHBondContact O-N 2.91Å; W70-A73 PolarHBondContact O-N 2.89Å; W70-G74 PolarHBondContact O-N 3.35Å; W70-M111 HydrophobicContact CB-CE 3.87Å; W70-M111 HydrophobicContact CD2-CE 3.55Å; W70-M111 HydrophobicContact CE3-CE 3.1Å; W70-M111 HydrophobicContact CE3-CG 4.02Å; W70-M111 HydrophobicContact CE3-SD 4.42Å; W70-M111 HydrophobicContact CG-CE 3.93Å; W70-M111 HydrophobicContact CH2-CG 4.03Å; W70-M111 HydrophobicContact CZ3-CE 3.75Å; W70-M111 HydrophobicContact CZ3-CG 3.66Å; W70-M111 WeakPolarHBondContact O-CE 3.39Å; W70-I114 HydrophobicContact CH2-CB 4.2Å; W70-I114 HydrophobicContact CH2-CG2 3.8Å; W70-I114 HydrophobicContact CZ2-CG2 4.5Å; W70-A115 HydrophobicContact CZ2-CB 4.12Å |
| 71 | C | 94.8 | Very high | 92.6 | Very high | 0 Ų | 0 | 48.8 Ų | 48.8 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -56.7 | -45 | 171.6 | -75.3 | 0 | 0 | 0 | 0 | 112.2 | V67 A73 G74 F75 A115 | V67-C71 WeakPolarHBondContact O-CB 3.29Å; V67-C71 PolarHBondContact O-N 3.02Å; V67-C71 PolarHBondContact O-SG 2.7Å; V67-C71 VanDerWaalsContact O-SG 3.39Å; C71-A73 PolarHBondContact O-N 3.48Å; C71-G74 PolarHBondContact O-N 2.93Å; C71-F75 HydrophobicContact CB-CE1 4.38Å; C71-F75 HydrophobicContact CB-CE2 3.89Å; C71-F75 HydrophobicContact CB-CZ 3.79Å; C71-F75 VanDerWaalsContact O-CD1 3.23Å; C71-F75 WeakPolarHBondContact O-CD1 3.43Å; C71-F75 WeakPolarHBondContact O-CD2 3.42Å; C71-F75 WeakPolarHBondContact O-CG 3.19Å; C71-F75 PolarHBondContact O-N 2.85Å; C71-A115 WeakPolarHBondContact SG-CB 3.34Å |
| 72 | S | 96.3 | Very high | 92.9 | Very high | 5 Ų | 5 | 40.2 Ų | 40.2 | 4% | 0.035 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -55.4 | -49.3 | 175.1 | 175.8 | 0 | 0 | 0 | 0 | 111.9 | G45 S49 G68 L69 W70 G74 F75 L76 | G45-S72 WeakPolarHBondContact O-CB 3.42Å; G45-S72 PolarHBondContact O-OG 3.25Å; S49-S72 WeakPolarHBondContact CB-OG 3.28Å; G68-S72 WeakPolarHBondContact O-CB 3.45Å; G68-S72 PolarHBondContact O-N 2.87Å; L69-S72 WeakPolarHBondContact O-CB 3.4Å; L69-S72 PolarHBondContact O-N 3.18Å; W70-S72 VanDerWaalsContact C-N 3.31Å; W70-S72 PolarHBondContact O-N 2.91Å; S72-G74 VanDerWaalsContact C-N 3.3Å; S72-G74 PolarHBondContact O-N 2.96Å; S72-F75 PolarHBondContact O-N 3.4Å; S72-L76 WeakPolarHBondContact O-CB 3.42Å; S72-L76 VanDerWaalsContact O-CG 3.23Å; S72-L76 WeakPolarHBondContact O-CG 3.45Å; S72-L76 PolarHBondContact O-N 3.43Å |
| 73 | A | 96.3 | Very high | 93.3 | Very high | 61 Ų | 61 | 36.2 Ų | 36.2 | 50% | 0.504 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -58.9 | -42.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | L69 W70 C71 L77 | L69-A73 PolarHBondContact O-N 3.33Å; W70-A73 PolarHBondContact O-N 2.89Å; C71-A73 PolarHBondContact O-N 3.48Å; A73-L77 WeakPolarHBondContact O-CB 3.44Å; A73-L77 PolarHBondContact O-N 3.04Å |
| 74 | G | 96.8 | Very high | 93.6 | Very high | 3 Ų | 3 | 34.6 Ų | 34.6 | 3% | 0.031 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60.5 | -47.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | W70 C71 S72 L77 I78 | W70-G74 PolarHBondContact O-N 3.35Å; C71-G74 PolarHBondContact O-N 2.93Å; S72-G74 VanDerWaalsContact C-N 3.3Å; S72-G74 PolarHBondContact O-N 2.96Å; G74-L77 WeakPolarHBondContact O-CB 3.41Å; G74-L77 PolarHBondContact O-N 2.86Å; G74-I78 WeakPolarHBondContact O-CG1 3.29Å; G74-I78 PolarHBondContact O-N 2.86Å |
| 75 | F | 97.6 | Very high | 93.7 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -67.6 | -38.5 | -177.6 | -58.3 | -11.9 | 0 | 0 | 0 | 112.3 | C71 S72 L77 I78 G79 F107 P112 I135 V139 | C71-F75 HydrophobicContact CB-CE1 4.38Å; C71-F75 HydrophobicContact CB-CE2 3.89Å; C71-F75 HydrophobicContact CB-CZ 3.79Å; C71-F75 VanDerWaalsContact O-CD1 3.23Å; C71-F75 WeakPolarHBondContact O-CD1 3.43Å; C71-F75 WeakPolarHBondContact O-CD2 3.42Å; C71-F75 WeakPolarHBondContact O-CG 3.19Å; C71-F75 PolarHBondContact O-N 2.85Å; S72-F75 PolarHBondContact O-N 3.4Å; F75-L77 VanDerWaalsContact C-N 3.34Å; F75-I78 HydrophobicContact CD1-CD1 4.45Å; F75-I78 WeakPolarHBondContact O-CG1 3.43Å; F75-G79 PolarHBondContact O-N 3.32Å; F75-F107 WeakPolarHBondContact CE1-O 3.48Å; F75-P112 HydrophobicContact CE1-CG 3.61Å; F75-P112 HydrophobicContact CZ-CG 3.88Å; F75-I135 HydrophobicContact CE2-CG2 4.13Å; F75-V139 HydrophobicContact CD1-CB 4.5Å; F75-V139 HydrophobicContact CD1-CG1 3.71Å; F75-V139 HydrophobicContact CD1-CG2 4.44Å; F75-V139 HydrophobicContact CD2-CG2 3.89Å; F75-V139 HydrophobicContact CE1-CB 4.24Å; F75-V139 HydrophobicContact CE1-CG1 3.66Å; F75-V139 HydrophobicContact CE1-CG2 4.47Å; F75-V139 HydrophobicContact CE2-CB 4.34Å; F75-V139 HydrophobicContact CE2-CG2 3.88Å; F75-V139 HydrophobicContact CG-CG1 4.23Å; F75-V139 HydrophobicContact CG-CG2 4.19Å; F75-V139 HydrophobicContact CZ-CB 4.14Å; F75-V139 HydrophobicContact CZ-CG1 4.08Å; F75-V139 HydrophobicContact CZ-CG2 4.19Å |
| 76 | L | 97.5 | Very high | 93.5 | Very high | 52 Ų | 52 | 28.8 Ų | 28.8 | 27% | 0.272 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -64.5 | -39.9 | 173.5 | -69.2 | 173 | 0 | 0 | 0 | 111.2 | L42 L46 S72 T80 | L42-L76 HydrophobicContact CD2-CD2 3.91Å; L46-L76 HydrophobicContact CD2-CD2 4.22Å; L46-L76 HydrophobicContact CG-CD2 4.09Å; S72-L76 WeakPolarHBondContact O-CB 3.42Å; S72-L76 VanDerWaalsContact O-CG 3.23Å; S72-L76 WeakPolarHBondContact O-CG 3.45Å; S72-L76 PolarHBondContact O-N 3.43Å; L76-T80 WeakPolarHBondContact O-CB 3.18Å; L76-T80 WeakPolarHBondContact O-CG2 3.49Å; L76-T80 PolarHBondContact O-N 2.97Å; L76-T80 PolarHBondContact O-OG1 3.33Å |
| 77 | L | 97 | Very high | 93.2 | Very high | 70 Ų | 70 | 33 Ų | 33 | 37% | 0.366 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -62.8 | -52.2 | 176.1 | -179.8 | 65.1 | 0 | 0 | 0 | 111.5 | A73 G74 F75 G79 T80 L81 F107 | A73-L77 WeakPolarHBondContact O-CB 3.44Å; A73-L77 PolarHBondContact O-N 3.04Å; G74-L77 WeakPolarHBondContact O-CB 3.41Å; G74-L77 PolarHBondContact O-N 2.86Å; F75-L77 VanDerWaalsContact C-N 3.34Å; L77-G79 VanDerWaalsContact C-N 3.33Å; L77-G79 PolarHBondContact O-N 3.5Å; L77-T80 PolarHBondContact O-N 3.19Å; L77-T80 PolarHBondContact O-OG1 2.82Å; L77-L81 HydrophobicContact CD1-CD1 4.38Å; L77-L81 HydrophobicContact CG-CD1 4.23Å; L77-L81 VanDerWaalsContact O-CG 3.29Å; L77-L81 WeakPolarHBondContact O-CG 3.37Å; L77-L81 PolarHBondContact O-N 3.13Å; L77-F107 HydrophobicContact CD2-CD2 4.04Å; L77-F107 HydrophobicContact CD2-CE2 3.75Å; L77-F107 HydrophobicContact CD2-CZ 4.25Å |
| 78 | I | 96.8 | Very high | 92.2 | Very high | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.005 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -67 | -35.1 | 179.5 | 58.2 | 174.7 | 0 | 0 | 0 | 112.2 | L41 G74 F75 L81 A82 C103 F107 V139 | L41-I78 HydrophobicContact CB-CG1 4.5Å; L41-I78 HydrophobicContact CD1-CB 4.47Å; L41-I78 HydrophobicContact CD1-CD1 4.01Å; L41-I78 HydrophobicContact CD1-CG1 3.98Å; L41-I78 HydrophobicContact CD2-CD1 3.82Å; L41-I78 HydrophobicContact CD2-CG1 4.36Å; L41-I78 HydrophobicContact CG-CD1 4.42Å; G74-I78 WeakPolarHBondContact O-CG1 3.29Å; G74-I78 PolarHBondContact O-N 2.86Å; F75-I78 HydrophobicContact CD1-CD1 4.45Å; F75-I78 WeakPolarHBondContact O-CG1 3.43Å; I78-L81 PolarHBondContact O-N 3.37Å; I78-A82 WeakPolarHBondContact O-CB 3.39Å; I78-A82 PolarHBondContact O-N 2.93Å; I78-C103 HydrophobicContact CG2-CB 3.97Å; I78-C103 WeakPolarHBondContact CG2-O 3.23Å; I78-F107 HydrophobicContact CG2-CB 3.87Å; I78-F107 HydrophobicContact CG2-CD2 4.45Å; I78-V139 HydrophobicContact CD1-CG1 4.28Å |
| 79 | G | 96.2 | Very high | 90.7 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -64.5 | -42.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | F75 L77 A82 M83 | F75-G79 PolarHBondContact O-N 3.32Å; L77-G79 VanDerWaalsContact C-N 3.33Å; L77-G79 PolarHBondContact O-N 3.5Å; G79-A82 PolarHBondContact O-N 3.18Å; G79-M83 WeakPolarHBondContact O-CG 3.35Å; G79-M83 PolarHBondContact O-N 3.35Å |
| 80 | T | 96 | Very high | 89.2 | Confident | 76 Ų | 76 | 46 Ų | 46 | 47% | 0.466 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -66.5 | -38.1 | 174.7 | 47.8 | 0 | 0 | 0 | 0 | 112.1 | L42 L76 L77 M83 G84 | L42-T80 HydrophobicContact CD2-CG2 3.82Å; L76-T80 WeakPolarHBondContact O-CB 3.18Å; L76-T80 WeakPolarHBondContact O-CG2 3.49Å; L76-T80 PolarHBondContact O-N 2.97Å; L76-T80 PolarHBondContact O-OG1 3.33Å; L77-T80 PolarHBondContact O-N 3.19Å; L77-T80 PolarHBondContact O-OG1 2.82Å; T80-M83 PolarHBondContact O-N 2.95Å; T80-G84 PolarHBondContact O-N 3.22Å |
| 81 | L | 94.7 | Very high | 87.9 | Confident | 25 Ų | 25 | 46.3 Ų | 46.3 | 13% | 0.131 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.2 | -42.4 | 175.2 | -70.3 | 172.8 | 0 | 0 | 0 | 112.2 | L77 I78 G84 L85 F96 F99 C103 | L77-L81 HydrophobicContact CD1-CD1 4.38Å; L77-L81 HydrophobicContact CG-CD1 4.23Å; L77-L81 VanDerWaalsContact O-CG 3.29Å; L77-L81 WeakPolarHBondContact O-CG 3.37Å; L77-L81 PolarHBondContact O-N 3.13Å; I78-L81 PolarHBondContact O-N 3.37Å; L81-G84 CarbonylContact O-C 3.31Å; L81-G84 WeakPolarHBondContact O-CA 3.42Å; L81-G84 PolarHBondContact O-N 3.47Å; L81-G84 VanDerWaalsContact O-N 3.12Å; L81-L85 PolarHBondContact O-N 3.24Å; L81-F96 HydrophobicContact CD2-CE2 4.05Å; L81-F96 HydrophobicContact CD2-CZ 4.27Å; L81-F99 HydrophobicContact CD1-CD1 4.34Å; L81-F99 HydrophobicContact CD1-CE1 3.86Å; L81-F99 HydrophobicContact CD2-CD1 4.38Å; L81-F99 HydrophobicContact CD2-CE1 4.01Å; L81-C103 HydrophobicContact CD1-CB 3.77Å |
| 82 | A | 92.3 | Very high | 86.9 | Confident | 1 Ų | 1 | 46.9 Ų | 46.9 | 1% | 0.008 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -64.2 | -41.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | I78 G79 G84 L85 Y86 | I78-A82 WeakPolarHBondContact O-CB 3.39Å; I78-A82 PolarHBondContact O-N 2.93Å; G79-A82 PolarHBondContact O-N 3.18Å; A82-G84 VanDerWaalsContact C-N 3.28Å; A82-G84 PolarHBondContact O-N 3.07Å; A82-L85 WeakPolarHBondContact O-CB 3.36Å; A82-L85 PolarHBondContact O-N 3.25Å; A82-Y86 PolarHBondContact O-N 3.48Å |
| 83 | M | 91.7 | Very high | 86.2 | Confident | 34 Ų | 34 | 49.4 Ų | 49.4 | 17% | 0.167 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.6 | -34.7 | 170.5 | -71.4 | -58 | -66.3 | 0 | 0 | 112.1 | M35 L39 L42 G79 T80 Y86 H87 | M35-M83 HydrophobicContact CG-CE 4.13Å; M35-M83 HydrophobicContact CG-SD 4.09Å; M35-M83 VanDerWaalsContact O-SD 3.37Å; L39-M83 HydrophobicContact CG-CE 4.45Å; L39-M83 HydrophobicContact CG-SD 4Å; L42-M83 HydrophobicContact CD1-CG 3.9Å; G79-M83 WeakPolarHBondContact O-CG 3.35Å; G79-M83 PolarHBondContact O-N 3.35Å; T80-M83 PolarHBondContact O-N 2.95Å; M83-Y86 HydrophobicContact CE-CD1 4.38Å; M83-Y86 WeakPolarHBondContact O-CB 3.39Å; M83-Y86 PolarHBondContact O-N 3.26Å; M83-H87 PolarHBondContact O-CD2 3.35Å; M83-H87 VanDerWaalsContact O-CD2 3.3Å; M83-H87 PolarHBondContact O-N 3.05Å; M83-H87 VanDerWaalsContact O-N 3.08Å |
| 84 | G | 88.7 | Confident | 85.5 | Confident | 24 Ų | 24 | 48.9 Ų | 48.9 | 25% | 0.247 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -59 | -47.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | T80 L81 A82 Y86 H87 Y88 | T80-G84 PolarHBondContact O-N 3.22Å; L81-G84 CarbonylContact O-C 3.31Å; L81-G84 WeakPolarHBondContact O-CA 3.42Å; L81-G84 PolarHBondContact O-N 3.47Å; L81-G84 VanDerWaalsContact O-N 3.12Å; A82-G84 VanDerWaalsContact C-N 3.28Å; A82-G84 PolarHBondContact O-N 3.07Å; G84-Y86 VanDerWaalsContact C-N 3.3Å; G84-Y86 PolarHBondContact O-N 3.37Å; G84-H87 PolarHBondContact O-N 3.02Å; G84-H87 VanDerWaalsContact O-N 3.1Å; G84-Y88 WeakPolarHBondContact O-CD2 3.4Å; G84-Y88 PolarHBondContact O-N 3.33Å |
| 85 | L | 86.4 | Confident | 85.1 | Confident | 1 Ų | 1 | 52.8 Ų | 52.8 | 1% | 0.005 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -55.8 | -43.2 | 175 | -79.8 | 164.2 | 0 | 0 | 0 | 112.2 | W30 L81 A82 H87 Y88 P92 F96 M97 C100 V150 | W30-L85 HydrophobicContact CH2-CB 4.23Å; W30-L85 HydrophobicContact CH2-CD2 4.34Å; W30-L85 HydrophobicContact CZ2-CB 4.49Å; W30-L85 HydrophobicContact CZ2-CD2 4.39Å; L81-L85 PolarHBondContact O-N 3.24Å; A82-L85 WeakPolarHBondContact O-CB 3.36Å; A82-L85 PolarHBondContact O-N 3.25Å; L85-H87 VanDerWaalsContact C-N 3.34Å; L85-H87 PolarHBondContact O-N 2.92Å; L85-Y88 PolarHBondContact O-N 2.8Å; L85-P92 HydrophobicContact CD2-CB 3.89Å; L85-P92 HydrophobicContact CD2-CG 3.87Å; L85-F96 HydrophobicContact CD2-CD1 3.78Å; L85-F96 HydrophobicContact CD2-CE1 3.7Å; L85-F96 HydrophobicContact CG-CD1 4.35Å; L85-F96 HydrophobicContact CG-CE1 3.78Å; L85-M97 HydrophobicContact CD2-CG 4.14Å; L85-C100 HydrophobicContact CD1-CB 3.92Å; L85-V150 HydrophobicContact CD1-CG2 4.49Å |
| 86 | Y | 84.4 | Confident | 84.6 | Confident | 67 Ų | 67 | 54.7 Ų | 54.7 | 26% | 0.263 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -64.2 | -35.5 | 176.3 | 167.3 | -105.9 | 0 | 0 | 0 | 113.5 | D31 M35 A82 M83 G84 Y88 | D31-Y86 HydrophobicContact CB-CD2 4.03Å; D31-Y86 HydrophobicContact CB-CE2 4.24Å; D31-Y86 VanDerWaalsContact O-CD2 3.31Å; D31-Y86 WeakPolarHBondContact O-CD2 3.34Å; M35-Y86 HydrophobicContact CB-CD1 4.23Å; M35-Y86 HydrophobicContact CB-CD2 3.79Å; M35-Y86 HydrophobicContact CB-CE2 4.2Å; M35-Y86 HydrophobicContact CB-CG 3.79Å; M35-Y86 HydrophobicContact CG-CD1 4.08Å; M35-Y86 HydrophobicContact CG-CD2 4.36Å; M35-Y86 HydrophobicContact CG-CE1 4.19Å; M35-Y86 HydrophobicContact CG-CE2 4.46Å; M35-Y86 HydrophobicContact CG-CG 4.16Å; M35-Y86 HydrophobicContact SD-CD1 4.5Å; M35-Y86 HydrophobicContact SD-CE1 4.01Å; M35-Y86 HydrophobicContact SD-CE2 4.12Å; A82-Y86 PolarHBondContact O-N 3.48Å; M83-Y86 HydrophobicContact CE-CD1 4.38Å; M83-Y86 WeakPolarHBondContact O-CB 3.39Å; M83-Y86 PolarHBondContact O-N 3.26Å; G84-Y86 VanDerWaalsContact C-N 3.3Å; G84-Y86 PolarHBondContact O-N 3.37Å; Y86-Y88 VanDerWaalsContact C-N 3.32Å; Y86-Y88 PolarHBondContact O-N 3.45Å |
| 87 | H | 81.4 | Confident | 84.2 | Confident | 115 Ų | 115 | 52.4 Ų | 52.4 | 53% | 0.532 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -76.6 | -18.4 | -177.1 | -86.3 | -68.5 | 0 | 0 | 0 | 114 | K3 M83 G84 L85 E89 | K3-H87 PolarHBondContact NZ-O 3.12Å; M83-H87 PolarHBondContact O-CD2 3.35Å; M83-H87 VanDerWaalsContact O-CD2 3.3Å; M83-H87 PolarHBondContact O-N 3.05Å; M83-H87 VanDerWaalsContact O-N 3.08Å; G84-H87 PolarHBondContact O-N 3.02Å; G84-H87 VanDerWaalsContact O-N 3.1Å; L85-H87 VanDerWaalsContact C-N 3.34Å; L85-H87 PolarHBondContact O-N 2.92Å; H87-E89 PolarHBondContact O-N 2.97Å |
| 88 | Y | 72.6 | Confident | 83.9 | Confident | 105 Ų | 105 | 53.3 Ų | 53.3 | 41% | 0.412 | 30% | 0.298 | S | S | . | . | trans | -56.8 | 124.9 | 176.2 | -98.9 | -95.7 | 0 | 0 | 0 | 111.2 | G84 L85 Y86 S90 P92 F96 | G84-Y88 WeakPolarHBondContact O-CD2 3.4Å; G84-Y88 PolarHBondContact O-N 3.33Å; L85-Y88 PolarHBondContact O-N 2.8Å; Y86-Y88 VanDerWaalsContact C-N 3.32Å; Y86-Y88 PolarHBondContact O-N 3.45Å; Y88-S90 VanDerWaalsContact C-N 3.29Å; Y88-P92 HydrophobicContact CD1-CB 4.49Å; Y88-P92 HydrophobicContact CG-CB 4.37Å; Y88-F96 HydrophobicContact CD2-CE1 4.24Å; Y88-F96 HydrophobicContact CE2-CD1 4.08Å; Y88-F96 AromaticContact CE2-CE1 3.87Å; Y88-F96 HydrophobicContact CE2-CE1 3.87Å; Y88-F96 HydrophobicContact CE2-CZ 4.43Å | ||
| 89 | E | 59.5 | Low | 83.7 | Confident | 154 Ų | 154 | 58.5 Ų | 58.5 | 72% | 0.72 | 32% | 0.321 | S | S | * | . | S | Bend | trans | -82.4 | -9.8 | 176.9 | -66.7 | -173.7 | 166 | 0 | 0 | 113.3 | K3 H87 | K3-E89 HydrophobicContact CD-CG 4.5Å; H87-E89 PolarHBondContact O-N 2.97Å |
| 90 | S | 62 | Low | 83.6 | Confident | 83 Ų | 83 | 58.6 Ų | 58.6 | 58% | 0.58 | 32% | 0.322 | S | S | * | . | S | Bend | trans | -131.1 | 162.4 | 179.8 | 52.4 | 0 | 0 | 0 | 0 | 109.3 | Y88 P92 | Y88-S90 VanDerWaalsContact C-N 3.29Å; S90-P92 WeakPolarHBondContact O-CD 3.4Å |
| 91 | V | 67.1 | Low | 83.5 | Confident | 96 Ų | 96 | 55.5 Ų | 55.5 | 58% | 0.582 | 30% | 0.303 | S | S | * | . | P | Polyproline II helix | trans | -50.3 | 117.9 | 177.1 | 179.2 | 0 | 0 | 0 | 0 | 109 | L157 | V91-L157 HydrophobicContact CG1-CD1 3.99Å; V91-L157 HydrophobicContact CG1-CD2 3.59Å; V91-L157 HydrophobicContact CG1-CG 4.45Å |
| 92 | P | 73.3 | Confident | 83.5 | Confident | 12 Ų | 12 | 59.2 Ų | 59.2 | 8% | 0.078 | 32% | 0.321 | C | S | . | . | P | Polyproline II helix | trans | -61.6 | 143.5 | -176.3 | 20.9 | -29.8 | 0 | 0 | 0 | 110.4 | W30 L85 Y88 S90 A94 F96 M97 | W30-P92 HydrophobicContact CH2-CG 4.06Å; L85-P92 HydrophobicContact CD2-CB 3.89Å; L85-P92 HydrophobicContact CD2-CG 3.87Å; Y88-P92 HydrophobicContact CD1-CB 4.49Å; Y88-P92 HydrophobicContact CG-CB 4.37Å; S90-P92 WeakPolarHBondContact O-CD 3.4Å; P92-A94 PolarHBondContact O-N 3.49Å; P92-F96 HydrophobicContact CB-CD1 4.26Å; P92-M97 HydrophobicContact CB-CG 4.05Å; P92-M97 HydrophobicContact CG-CG 3.9Å; P92-M97 HydrophobicContact CG-SD 3.94Å |
| 93 | S | 81.4 | Confident | 83.7 | Confident | 57 Ų | 57 | 59.5 Ų | 59.5 | 40% | 0.399 | 32% | 0.323 | S | S | . | . | P | Polyproline II helix | trans | -57.9 | 140.6 | 178.9 | 65.5 | 0 | 0 | 0 | 0 | 111.1 | S95 F96 M97 | S93-S95 PolarHBondContact O-N 3.31Å; S93-S95 PolarHBondContact OG-OG 3.47Å; S93-F96 WeakPolarHBondContact O-CB 3.5Å; S93-F96 PolarHBondContact O-N 3.18Å; S93-F96 VanDerWaalsContact OG-CB 3.28Å; S93-F96 WeakPolarHBondContact OG-CB 3.46Å; S93-F96 PolarHBondContact OG-N 3.44Å; S93-M97 PolarHBondContact O-N 2.9Å |
| 94 | A | 82.6 | Confident | 83.9 | Confident | 51 Ų | 51 | 58 Ų | 58 | 42% | 0.421 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -58.4 | -33 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | P92 L98 L154 | P92-A94 PolarHBondContact O-N 3.49Å; A94-L98 WeakPolarHBondContact O-CB 3.33Å; A94-L98 WeakPolarHBondContact O-CG 3.43Å; A94-L98 PolarHBondContact O-N 2.91Å; A94-L154 HydrophobicContact CB-CD2 3.96Å |
| 95 | S | 87 | Confident | 84.2 | Confident | 85 Ų | 85 | 60.1 Ų | 60.1 | 59% | 0.594 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -63.6 | -42.2 | 173.7 | 50.4 | 0 | 0 | 0 | 0 | 112.1 | S93 L98 F99 | S93-S95 PolarHBondContact O-N 3.31Å; S93-S95 PolarHBondContact OG-OG 3.47Å; S95-L98 PolarHBondContact O-N 2.97Å; S95-F99 WeakPolarHBondContact O-CB 3.31Å; S95-F99 PolarHBondContact O-N 2.93Å |
| 96 | F | 87.4 | Confident | 84.7 | Confident | 40 Ų | 40 | 64.8 Ų | 64.8 | 18% | 0.175 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -66.7 | -44.1 | 176.6 | -176.3 | -115.2 | 0 | 0 | 0 | 111.8 | L81 L85 Y88 P92 S93 L98 F99 C100 | L81-F96 HydrophobicContact CD2-CE2 4.05Å; L81-F96 HydrophobicContact CD2-CZ 4.27Å; L85-F96 HydrophobicContact CD2-CD1 3.78Å; L85-F96 HydrophobicContact CD2-CE1 3.7Å; L85-F96 HydrophobicContact CG-CD1 4.35Å; L85-F96 HydrophobicContact CG-CE1 3.78Å; Y88-F96 HydrophobicContact CD2-CE1 4.24Å; Y88-F96 HydrophobicContact CE2-CD1 4.08Å; Y88-F96 AromaticContact CE2-CE1 3.87Å; Y88-F96 HydrophobicContact CE2-CE1 3.87Å; Y88-F96 HydrophobicContact CE2-CZ 4.43Å; P92-F96 HydrophobicContact CB-CD1 4.26Å; S93-F96 WeakPolarHBondContact O-CB 3.5Å; S93-F96 PolarHBondContact O-N 3.18Å; S93-F96 VanDerWaalsContact OG-CB 3.28Å; S93-F96 WeakPolarHBondContact OG-CB 3.46Å; S93-F96 PolarHBondContact OG-N 3.44Å; F96-L98 VanDerWaalsContact C-N 3.33Å; F96-L98 PolarHBondContact O-N 3.16Å; F96-F99 WeakPolarHBondContact O-CB 3.34Å; F96-F99 PolarHBondContact O-N 3.03Å; F96-F99 VanDerWaalsContact O-N 3.16Å; F96-C100 PolarHBondContact O-N 3.36Å; F96-C100 PolarHBondContact O-SG 2.96Å |
| 97 | M | 89 | Confident | 85.2 | Confident | 4 Ų | 4 | 64.8 Ų | 64.8 | 2% | 0.02 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -61.7 | -41.2 | 176.1 | -63.3 | -179.3 | 81.8 | 0 | 0 | 112.1 | W30 L85 P92 S93 F99 C100 V101 V150 E153 L154 L157 | W30-M97 HydrophobicContact CZ2-CE 4.45Å; L85-M97 HydrophobicContact CD2-CG 4.14Å; P92-M97 HydrophobicContact CB-CG 4.05Å; P92-M97 HydrophobicContact CG-CG 3.9Å; P92-M97 HydrophobicContact CG-SD 3.94Å; S93-M97 PolarHBondContact O-N 2.9Å; M97-F99 VanDerWaalsContact C-N 3.33Å; M97-C100 PolarHBondContact O-N 3.49Å; M97-V101 WeakPolarHBondContact O-CG2 3.28Å; M97-V101 PolarHBondContact O-N 3.35Å; M97-V150 HydrophobicContact CB-CG1 4.17Å; M97-V150 HydrophobicContact CE-CG1 4.1Å; M97-E153 HydrophobicContact CE-CB 3.67Å; M97-L154 HydrophobicContact CB-CD1 3.82Å; M97-L154 HydrophobicContact CB-CD2 3.87Å; M97-L154 HydrophobicContact CB-CG 3.71Å; M97-L154 HydrophobicContact CE-CG 4.28Å; M97-L154 HydrophobicContact SD-CD2 4.28Å; M97-L154 HydrophobicContact SD-CG 4.15Å; M97-L157 HydrophobicContact SD-CD1 3.61Å |
| 98 | L | 90.9 | Very high | 85.9 | Confident | 88 Ų | 88 | 59.3 Ų | 59.3 | 46% | 0.461 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.3 | -40.9 | 174.6 | -82 | 166.8 | 0 | 0 | 0 | 111.5 | A94 S95 F96 V101 M102 L154 | A94-L98 WeakPolarHBondContact O-CB 3.33Å; A94-L98 WeakPolarHBondContact O-CG 3.43Å; A94-L98 PolarHBondContact O-N 2.91Å; S95-L98 PolarHBondContact O-N 2.97Å; F96-L98 VanDerWaalsContact C-N 3.33Å; F96-L98 PolarHBondContact O-N 3.16Å; L98-V101 PolarHBondContact O-N 3.42Å; L98-M102 VanDerWaalsContact O-CG 3.31Å; L98-M102 WeakPolarHBondContact O-CG 3.42Å; L98-M102 PolarHBondContact O-N 3.34Å; L98-L154 HydrophobicContact CD2-CD1 3.91Å; L98-L154 HydrophobicContact CG-CD1 3.88Å; L98-L154 HydrophobicContact CG-CD2 4.17Å |
| 99 | F | 93.7 | Very high | 87 | Confident | 111 Ų | 111 | 56 Ų | 56 | 49% | 0.487 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -60.8 | -45.6 | 175.1 | 179.3 | -102 | 0 | 0 | 0 | 111.6 | L81 S95 F96 M97 V101 M102 C103 | L81-F99 HydrophobicContact CD1-CD1 4.34Å; L81-F99 HydrophobicContact CD1-CE1 3.86Å; L81-F99 HydrophobicContact CD2-CD1 4.38Å; L81-F99 HydrophobicContact CD2-CE1 4.01Å; S95-F99 WeakPolarHBondContact O-CB 3.31Å; S95-F99 PolarHBondContact O-N 2.93Å; F96-F99 WeakPolarHBondContact O-CB 3.34Å; F96-F99 PolarHBondContact O-N 3.03Å; F96-F99 VanDerWaalsContact O-N 3.16Å; M97-F99 VanDerWaalsContact C-N 3.33Å; F99-V101 PolarHBondContact O-N 3.29Å; F99-M102 PolarHBondContact O-N 2.91Å; F99-C103 VanDerWaalsContact CZ-SG 3.56Å; F99-C103 PolarHBondContact O-N 2.94Å; F99-C103 PolarHBondContact O-SG 3.47Å; F99-C103 VanDerWaalsContact O-SG 3.39Å |
| 100 | C | 93.1 | Very high | 88.7 | Confident | 2 Ų | 2 | 52.1 Ų | 52.1 | 1% | 0.014 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -56.8 | -47.3 | 174.4 | -66.5 | 0 | 0 | 0 | 0 | 111.9 | L85 F96 M97 M102 C103 D104 | L85-C100 HydrophobicContact CD1-CB 3.92Å; F96-C100 PolarHBondContact O-N 3.36Å; F96-C100 PolarHBondContact O-SG 2.96Å; M97-C100 PolarHBondContact O-N 3.49Å; C100-M102 VanDerWaalsContact C-N 3.33Å; C100-M102 PolarHBondContact O-N 2.95Å; C100-C103 PolarHBondContact O-N 3.5Å; C100-D104 PolarHBondContact O-N 2.89Å |
| 101 | V | 93.9 | Very high | 90.3 | Very high | 10 Ų | 10 | 49.1 Ų | 49.1 | 6% | 0.061 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -58.6 | -43.9 | 176.4 | 164.5 | 0 | 0 | 0 | 0 | 111.7 | M97 L98 F99 C103 D104 L105 T147 V150 L154 | M97-V101 WeakPolarHBondContact O-CG2 3.28Å; M97-V101 PolarHBondContact O-N 3.35Å; L98-V101 PolarHBondContact O-N 3.42Å; F99-V101 PolarHBondContact O-N 3.29Å; V101-C103 VanDerWaalsContact C-N 3.34Å; V101-C103 PolarHBondContact O-N 3.49Å; V101-D104 PolarHBondContact O-N 3.32Å; V101-L105 HydrophobicContact CG1-CD1 4.18Å; V101-L105 WeakPolarHBondContact O-CG 3.01Å; V101-L105 PolarHBondContact O-N 2.68Å; V101-T147 HydrophobicContact CG1-CG2 3.91Å; V101-V150 HydrophobicContact CG2-CB 3.87Å; V101-V150 HydrophobicContact CG2-CG1 3.54Å; V101-L154 HydrophobicContact CG2-CD1 4.36Å |
| 102 | M | 95.7 | Very high | 91.6 | Very high | 104 Ų | 104 | 44.6 Ų | 44.6 | 51% | 0.512 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -64.9 | -40.1 | 178 | -68.5 | -64.5 | 158.8 | 0 | 0 | 111.8 | L98 F99 C100 L105 L106 | L98-M102 VanDerWaalsContact O-CG 3.31Å; L98-M102 WeakPolarHBondContact O-CG 3.42Å; L98-M102 PolarHBondContact O-N 3.34Å; F99-M102 PolarHBondContact O-N 2.91Å; C100-M102 VanDerWaalsContact C-N 3.33Å; C100-M102 PolarHBondContact O-N 2.95Å; M102-L105 PolarHBondContact O-N 3.2Å; M102-L105 HydrophobicContact SD-CD1 4.38Å; M102-L106 WeakPolarHBondContact O-CB 3.49Å; M102-L106 WeakPolarHBondContact O-CG 3.43Å; M102-L106 PolarHBondContact O-N 2.7Å |
| 103 | C | 96.3 | Very high | 92.7 | Very high | 7 Ų | 7 | 49 Ų | 49 | 5% | 0.047 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.4 | -41.8 | 174.6 | -70.3 | 0 | 0 | 0 | 0 | 112 | I78 L81 F99 C100 V101 L106 F107 | I78-C103 HydrophobicContact CG2-CB 3.97Å; I78-C103 WeakPolarHBondContact CG2-O 3.23Å; L81-C103 HydrophobicContact CD1-CB 3.77Å; F99-C103 VanDerWaalsContact CZ-SG 3.56Å; F99-C103 PolarHBondContact O-N 2.94Å; F99-C103 PolarHBondContact O-SG 3.47Å; F99-C103 VanDerWaalsContact O-SG 3.39Å; C100-C103 PolarHBondContact O-N 3.5Å; V101-C103 VanDerWaalsContact C-N 3.34Å; V101-C103 PolarHBondContact O-N 3.49Å; C103-L106 PolarHBondContact O-N 2.72Å; C103-F107 HydrophobicContact CB-CD2 4.2Å; C103-F107 WeakPolarHBondContact O-CB 3.28Å; C103-F107 WeakPolarHBondContact O-CD2 3.4Å; C103-F107 PolarHBondContact O-N 3.44Å |
| 104 | D | 94.6 | Very high | 93.3 | Very high | 3 Ų | 3 | 49.8 Ų | 49.8 | 2% | 0.016 | 27% | 0.268 | C | S | . | . | I | π-helix | trans | -62.4 | -42.7 | 175.5 | -73.5 | -31.8 | 0 | 0 | 0 | 112.1 | C100 V101 G108 I109 H146 T147 | C100-D104 PolarHBondContact O-N 2.89Å; V101-D104 PolarHBondContact O-N 3.32Å; D104-G108 CarbonylContact O-C 3.59Å; D104-G108 VanDerWaalsContact O-C 3.31Å; D104-G108 WeakPolarHBondContact O-CA 3.38Å; D104-G108 PolarHBondContact O-N 3.45Å; D104-I109 PolarHBondContact O-N 2.94Å; D104-I109 VanDerWaalsContact O-N 3.13Å; D104-H146 IonicContact OD1-ND1 3.48Å; D104-H146 IonicContact OD2-CE1 3.77Å; D104-H146 PolarHBondContact OD2-CE1 3.48Å; D104-H146 IonicContact OD2-CG 2.68Å; D104-H146 IonicContact OD2-ND1 3.79Å; D104-H146 PolarHBondContact OD2-ND1 3.03Å; D104-T147 VanDerWaalsContact CB-OG1 3.28Å; D104-T147 WeakPolarHBondContact CB-OG1 3.35Å |
| 105 | L | 95.5 | Very high | 93.8 | Very high | 67 Ų | 67 | 47.3 Ų | 47.3 | 35% | 0.351 | 25% | 0.248 | S | C | . | . | I | π-helix | trans | -61.4 | -47.8 | 176 | -72.1 | 172.7 | 0 | 0 | 0 | 111.1 | V101 M102 I109 V110 T147 | V101-L105 HydrophobicContact CG1-CD1 4.18Å; V101-L105 WeakPolarHBondContact O-CG 3.01Å; V101-L105 PolarHBondContact O-N 2.68Å; M102-L105 PolarHBondContact O-N 3.2Å; M102-L105 HydrophobicContact SD-CD1 4.38Å; L105-I109 HydrophobicContact CD2-CD1 3.83Å; L105-I109 WeakPolarHBondContact O-CB 3.3Å; L105-I109 PolarHBondContact O-N 3.2Å; L105-V110 WeakPolarHBondContact O-CG2 3.38Å; L105-V110 PolarHBondContact O-N 3.22Å; L105-T147 HydrophobicContact CD2-CG2 4.18Å; L105-T147 HydrophobicContact CG-CG2 4.37Å |
| 106 | L | 96.8 | Very high | 94.1 | Very high | 100 Ų | 100 | 44.7 Ų | 44.7 | 52% | 0.524 | 23% | 0.227 | S | C | . | . | I | π-helix | trans | -72.2 | -53.8 | -176.1 | -70.4 | 172.5 | 0 | 0 | 0 | 112.6 | M102 C103 M111 | M102-L106 WeakPolarHBondContact O-CB 3.49Å; M102-L106 WeakPolarHBondContact O-CG 3.43Å; M102-L106 PolarHBondContact O-N 2.7Å; C103-L106 PolarHBondContact O-N 2.72Å; L106-M111 VanDerWaalsContact O-CB 3.29Å; L106-M111 WeakPolarHBondContact O-CB 3.38Å; L106-M111 PolarHBondContact O-N 2.93Å |
| 107 | F | 96.3 | Very high | 94.4 | Very high | 66 Ų | 66 | 46.8 Ų | 46.8 | 29% | 0.289 | 24% | 0.243 | S | C | . | . | I | π-helix | trans | -94.7 | -23.2 | -172 | -59.7 | -69.5 | 0 | 0 | 0 | 113.5 | F75 L77 I78 C103 M111 P112 | F75-F107 WeakPolarHBondContact CE1-O 3.48Å; L77-F107 HydrophobicContact CD2-CD2 4.04Å; L77-F107 HydrophobicContact CD2-CE2 3.75Å; L77-F107 HydrophobicContact CD2-CZ 4.25Å; I78-F107 HydrophobicContact CG2-CB 3.87Å; I78-F107 HydrophobicContact CG2-CD2 4.45Å; C103-F107 HydrophobicContact CB-CD2 4.2Å; C103-F107 WeakPolarHBondContact O-CB 3.28Å; C103-F107 WeakPolarHBondContact O-CD2 3.4Å; C103-F107 PolarHBondContact O-N 3.44Å; F107-M111 HydrophobicContact CB-SD 4.44Å; F107-M111 HydrophobicContact CD1-SD 3.83Å; F107-P112 WeakPolarHBondContact O-CD 3.38Å |
| 108 | G | 95.2 | Very high | 94.5 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 26% | 0.259 | C | S | . | . | I | π-helix | trans | -96 | -18.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | D104 P112 G140 S143 | D104-G108 CarbonylContact O-C 3.59Å; D104-G108 VanDerWaalsContact O-C 3.31Å; D104-G108 WeakPolarHBondContact O-CA 3.38Å; D104-G108 PolarHBondContact O-N 3.45Å; G108-P112 WeakPolarHBondContact O-CG 3.19Å; G108-G140 VanDerWaalsContact O-CA 3.3Å; G108-G140 WeakPolarHBondContact O-CA 3.36Å; G108-S143 VanDerWaalsContact CA-OG 3.28Å; G108-S143 WeakPolarHBondContact CA-OG 3.25Å; G108-S143 WeakPolarHBondContact O-CB 3.47Å |
| 109 | I | 95.6 | Very high | 94.4 | Very high | 36 Ų | 36 | 46.5 Ų | 46.5 | 19% | 0.185 | 24% | 0.238 | C | C | . | . | I | π-helix | trans | -124.5 | -62.5 | 179.8 | -53.1 | 178.4 | 0 | 0 | 0 | 111.5 | D104 L105 M111 P112 L113 I144 | D104-I109 PolarHBondContact O-N 2.94Å; D104-I109 VanDerWaalsContact O-N 3.13Å; L105-I109 HydrophobicContact CD2-CD1 3.83Å; L105-I109 WeakPolarHBondContact O-CB 3.3Å; L105-I109 PolarHBondContact O-N 3.2Å; I109-M111 PolarHBondContact O-N 3.01Å; I109-P112 WeakPolarHBondContact O-CD 3.21Å; I109-L113 HydrophobicContact CG2-CD1 4.04Å; I109-L113 VanDerWaalsContact O-CG 3.28Å; I109-L113 WeakPolarHBondContact O-CG 3.5Å; I109-L113 PolarHBondContact O-N 2.88Å; I109-L113 VanDerWaalsContact O-N 3.08Å; I109-I144 HydrophobicContact CD1-CG1 3.6Å; I109-I144 HydrophobicContact CG1-CG1 4.08Å |
| 110 | V | 96.4 | Very high | 94.1 | Very high | 72 Ų | 72 | 45.5 Ų | 45.5 | 44% | 0.436 | 24% | 0.237 | S | C | . | . | I | π-helix | trans | -63.1 | -48.9 | -173.2 | 174.2 | 0 | 0 | 0 | 0 | 111 | L105 L113 I114 | L105-V110 WeakPolarHBondContact O-CG2 3.38Å; L105-V110 PolarHBondContact O-N 3.22Å; V110-L113 PolarHBondContact O-N 3.19Å; V110-I114 HydrophobicContact CG1-CD1 3.87Å; V110-I114 WeakPolarHBondContact O-CG1 3.28Å; V110-I114 PolarHBondContact O-N 2.85Å; V110-I114 VanDerWaalsContact O-N 3.08Å |
| 111 | M | 95.1 | Very high | 93.8 | Very high | 20 Ų | 20 | 50.5 Ų | 50.5 | 10% | 0.099 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -61.7 | -48.3 | 179.7 | 178 | -168.1 | -140.5 | 0 | 0 | 112.7 | W70 L106 F107 I109 L113 I114 A115 | W70-M111 HydrophobicContact CB-CE 3.87Å; W70-M111 HydrophobicContact CD2-CE 3.55Å; W70-M111 HydrophobicContact CE3-CE 3.1Å; W70-M111 HydrophobicContact CE3-CG 4.02Å; W70-M111 HydrophobicContact CE3-SD 4.42Å; W70-M111 HydrophobicContact CG-CE 3.93Å; W70-M111 HydrophobicContact CH2-CG 4.03Å; W70-M111 HydrophobicContact CZ3-CE 3.75Å; W70-M111 HydrophobicContact CZ3-CG 3.66Å; W70-M111 WeakPolarHBondContact O-CE 3.39Å; L106-M111 VanDerWaalsContact O-CB 3.29Å; L106-M111 WeakPolarHBondContact O-CB 3.38Å; L106-M111 PolarHBondContact O-N 2.93Å; F107-M111 HydrophobicContact CB-SD 4.44Å; F107-M111 HydrophobicContact CD1-SD 3.83Å; I109-M111 PolarHBondContact O-N 3.01Å; M111-L113 VanDerWaalsContact C-N 3.32Å; M111-L113 PolarHBondContact O-N 3.45Å; M111-I114 PolarHBondContact O-N 2.81Å; M111-A115 WeakPolarHBondContact O-CB 3.49Å; M111-A115 PolarHBondContact O-N 3.3Å |
| 112 | P | 94.9 | Very high | 93.4 | Very high | 2 Ų | 2 | 53 Ų | 53 | 1% | 0.013 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -54.4 | -42.2 | 171.5 | -35 | 38.9 | 0 | 0 | 0 | 114.6 | F75 F107 G108 I109 I114 A115 I116 C136 V139 | F75-P112 HydrophobicContact CE1-CG 3.61Å; F75-P112 HydrophobicContact CZ-CG 3.88Å; F107-P112 WeakPolarHBondContact O-CD 3.38Å; G108-P112 WeakPolarHBondContact O-CG 3.19Å; I109-P112 WeakPolarHBondContact O-CD 3.21Å; P112-I114 VanDerWaalsContact C-N 3.35Å; P112-I114 PolarHBondContact O-N 3.18Å; P112-A115 WeakPolarHBondContact O-CB 3.25Å; P112-A115 PolarHBondContact O-N 3.38Å; P112-I116 WeakPolarHBondContact O-CB 3.41Å; P112-I116 WeakPolarHBondContact O-CD1 3.46Å; P112-I116 WeakPolarHBondContact O-CG1 3.48Å; P112-I116 PolarHBondContact O-N 3.3Å; P112-C136 HydrophobicContact CB-CB 4.02Å; P112-V139 HydrophobicContact CG-CG1 4.4Å |
| 113 | L | 95 | Very high | 92.1 | Very high | 104 Ų | 104 | 48.3 Ų | 48.3 | 55% | 0.545 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 178.1 | -72.1 | 171.2 | 0 | 0 | 0 | 111.3 | I109 V110 M111 A115 I116 V117 | I109-L113 HydrophobicContact CG2-CD1 4.04Å; I109-L113 VanDerWaalsContact O-CG 3.28Å; I109-L113 WeakPolarHBondContact O-CG 3.5Å; I109-L113 PolarHBondContact O-N 2.88Å; I109-L113 VanDerWaalsContact O-N 3.08Å; V110-L113 PolarHBondContact O-N 3.19Å; M111-L113 VanDerWaalsContact C-N 3.32Å; M111-L113 PolarHBondContact O-N 3.45Å; L113-A115 VanDerWaalsContact C-N 3.33Å; L113-A115 PolarHBondContact O-N 3.25Å; L113-I116 PolarHBondContact O-N 3.38Å; L113-V117 WeakPolarHBondContact O-CG2 3.46Å; L113-V117 PolarHBondContact O-N 3.08Å |
| 114 | I | 94.8 | Very high | 90.4 | Very high | 73 Ų | 73 | 54.5 Ų | 54.5 | 37% | 0.374 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | 175.6 | -64.1 | 167.1 | 0 | 0 | 0 | 110.3 | W70 V110 M111 P112 I116 V117 F118 | W70-I114 HydrophobicContact CH2-CB 4.2Å; W70-I114 HydrophobicContact CH2-CG2 3.8Å; W70-I114 HydrophobicContact CZ2-CG2 4.5Å; V110-I114 HydrophobicContact CG1-CD1 3.87Å; V110-I114 WeakPolarHBondContact O-CG1 3.28Å; V110-I114 PolarHBondContact O-N 2.85Å; V110-I114 VanDerWaalsContact O-N 3.08Å; M111-I114 PolarHBondContact O-N 2.81Å; P112-I114 VanDerWaalsContact C-N 3.35Å; P112-I114 PolarHBondContact O-N 3.18Å; I114-I116 PolarHBondContact O-N 2.97Å; I114-V117 PolarHBondContact O-N 3.3Å; I114-F118 HydrophobicContact CG2-CD2 3.65Å; I114-F118 HydrophobicContact CG2-CE2 3.43Å; I114-F118 VanDerWaalsContact CG2-CE2 3.43Å; I114-F118 VanDerWaalsContact O-CD2 3.27Å; I114-F118 WeakPolarHBondContact O-CD2 3.39Å; I114-F118 PolarHBondContact O-N 3.24Å |
| 115 | A | 93.2 | Very high | 89 | Confident | 0 Ų | 0 | 62.3 Ų | 62.3 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -61.4 | -43.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | V67 W70 C71 M111 P112 L113 V117 F118 T119 | V67-A115 HydrophobicContact CG2-CB 3.76Å; W70-A115 HydrophobicContact CZ2-CB 4.12Å; C71-A115 WeakPolarHBondContact SG-CB 3.34Å; M111-A115 WeakPolarHBondContact O-CB 3.49Å; M111-A115 PolarHBondContact O-N 3.3Å; P112-A115 WeakPolarHBondContact O-CB 3.25Å; P112-A115 PolarHBondContact O-N 3.38Å; L113-A115 VanDerWaalsContact C-N 3.33Å; L113-A115 PolarHBondContact O-N 3.25Å; A115-V117 VanDerWaalsContact C-N 3.29Å; A115-V117 PolarHBondContact O-N 3.45Å; A115-F118 PolarHBondContact O-N 3.47Å; A115-F118 VanDerWaalsContact O-N 3.14Å; A115-T119 WeakPolarHBondContact O-CG2 3.24Å; A115-T119 PolarHBondContact O-N 3.31Å; A115-T119 PolarHBondContact O-OG1 3.3Å; A115-T119 VanDerWaalsContact O-OG1 3.14Å |
| 116 | I | 93.1 | Very high | 88.2 | Confident | 30 Ų | 30 | 61 Ų | 61 | 15% | 0.154 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -58.3 | -42.6 | 175.3 | -70.1 | 161.4 | 0 | 0 | 0 | 110.7 | P112 L113 I114 F118 T119 I120 T133 C136 I137 | P112-I116 WeakPolarHBondContact O-CB 3.41Å; P112-I116 WeakPolarHBondContact O-CD1 3.46Å; P112-I116 WeakPolarHBondContact O-CG1 3.48Å; P112-I116 PolarHBondContact O-N 3.3Å; L113-I116 PolarHBondContact O-N 3.38Å; I114-I116 PolarHBondContact O-N 2.97Å; I116-F118 PolarHBondContact O-N 2.85Å; I116-T119 WeakPolarHBondContact CA-OG1 3.5Å; I116-T119 PolarHBondContact O-OG1 3.32Å; I116-I120 HydrophobicContact CG2-CD1 3.55Å; I116-I120 HydrophobicContact CG2-CG1 4.34Å; I116-I120 VanDerWaalsContact O-CB 3.31Å; I116-I120 WeakPolarHBondContact O-CB 3.33Å; I116-I120 WeakPolarHBondContact O-CD1 3.36Å; I116-I120 WeakPolarHBondContact O-CG1 3.42Å; I116-I120 PolarHBondContact O-N 3.1Å; I116-T133 HydrophobicContact CB-CG2 4.5Å; I116-T133 HydrophobicContact CG1-CG2 4.1Å; I116-T133 HydrophobicContact CG2-CG2 4.12Å; I116-C136 HydrophobicContact CD1-CB 4.09Å; I116-C136 HydrophobicContact CG1-CB 3.79Å; I116-I137 HydrophobicContact CD1-CG1 3.67Å; I116-I137 HydrophobicContact CG1-CG1 4.38Å |
| 117 | V | 92.8 | Very high | 87.5 | Confident | 84 Ų | 84 | 61.7 Ų | 61.7 | 51% | 0.509 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.8 | -42.2 | 176.8 | 175 | 0 | 0 | 0 | 0 | 111.1 | L113 I114 A115 N121 | L113-V117 WeakPolarHBondContact O-CG2 3.46Å; L113-V117 PolarHBondContact O-N 3.08Å; I114-V117 PolarHBondContact O-N 3.3Å; A115-V117 VanDerWaalsContact C-N 3.29Å; A115-V117 PolarHBondContact O-N 3.45Å; V117-N121 WeakPolarHBondContact O-CB 3.19Å; V117-N121 PolarHBondContact O-N 3.08Å; V117-N121 VanDerWaalsContact O-N 3.16Å; V117-N121 PolarHBondContact O-ND2 3.32Å |
| 118 | F | 91.6 | Very high | 86.8 | Confident | 83 Ų | 83 | 61.4 Ų | 61.4 | 36% | 0.364 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -67.9 | -45.3 | 177.3 | -79.8 | -63.7 | 0 | 0 | 0 | 112.8 | Y65 V67 I114 A115 I116 I120 N121 C122 | Y65-F118 AromaticContact CD2-CD1 3.99Å; Y65-F118 HydrophobicContact CD2-CD1 3.99Å; Y65-F118 HydrophobicContact CD2-CE1 4.19Å; Y65-F118 HydrophobicContact CE2-CD1 4.08Å; Y65-F118 HydrophobicContact CE2-CE1 4.1Å; V67-F118 HydrophobicContact CG2-CB 4.35Å; I114-F118 HydrophobicContact CG2-CD2 3.65Å; I114-F118 HydrophobicContact CG2-CE2 3.43Å; I114-F118 VanDerWaalsContact CG2-CE2 3.43Å; I114-F118 VanDerWaalsContact O-CD2 3.27Å; I114-F118 WeakPolarHBondContact O-CD2 3.39Å; I114-F118 PolarHBondContact O-N 3.24Å; A115-F118 PolarHBondContact O-N 3.47Å; A115-F118 VanDerWaalsContact O-N 3.14Å; I116-F118 PolarHBondContact O-N 2.85Å; F118-I120 VanDerWaalsContact C-N 3.35Å; F118-I120 PolarHBondContact O-N 3.45Å; F118-N121 PolarHBondContact O-N 3.45Å; F118-C122 VanDerWaalsContact O-CB 3.3Å; F118-C122 WeakPolarHBondContact O-CB 3.25Å; F118-C122 PolarHBondContact O-N 3.29Å |
| 119 | T | 89.7 | Confident | 86.4 | Confident | 3 Ų | 3 | 61.7 Ų | 61.7 | 2% | 0.018 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -64.1 | -40.1 | 179.7 | 54.4 | 0 | 0 | 0 | 0 | 111.5 | V67 A115 I116 N121 G123 Y129 I132 T133 | V67-T119 HydrophobicContact CB-CG2 4.47Å; V67-T119 HydrophobicContact CG1-CG2 3.43Å; V67-T119 VanDerWaalsContact CG1-CG2 3.43Å; V67-T119 HydrophobicContact CG2-CG2 4.36Å; A115-T119 WeakPolarHBondContact O-CG2 3.24Å; A115-T119 PolarHBondContact O-N 3.31Å; A115-T119 PolarHBondContact O-OG1 3.3Å; A115-T119 VanDerWaalsContact O-OG1 3.14Å; I116-T119 WeakPolarHBondContact CA-OG1 3.5Å; I116-T119 PolarHBondContact O-OG1 3.32Å; T119-N121 PolarHBondContact O-N 2.95Å; T119-G123 WeakPolarHBondContact O-CA 3.42Å; T119-G123 PolarHBondContact O-N 2.91Å; T119-Y129 HydrophobicContact CG2-CD1 4.07Å; T119-I132 HydrophobicContact CG2-CG2 4.13Å; T119-T133 VanDerWaalsContact CB-OG1 3.24Å; T119-T133 WeakPolarHBondContact CB-OG1 3.48Å; T119-T133 PolarHBondContact OG1-OG1 3.46Å |
| 120 | I | 87.2 | Confident | 86 | Confident | 90 Ų | 90 | 67.1 Ų | 67.1 | 46% | 0.462 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -66.8 | -36.7 | 177.1 | -70.1 | 171 | 0 | 0 | 0 | 111.6 | I116 F118 K124 | I116-I120 HydrophobicContact CG2-CD1 3.55Å; I116-I120 HydrophobicContact CG2-CG1 4.34Å; I116-I120 VanDerWaalsContact O-CB 3.31Å; I116-I120 WeakPolarHBondContact O-CB 3.33Å; I116-I120 WeakPolarHBondContact O-CD1 3.36Å; I116-I120 WeakPolarHBondContact O-CG1 3.42Å; I116-I120 PolarHBondContact O-N 3.1Å; F118-I120 VanDerWaalsContact C-N 3.35Å; F118-I120 PolarHBondContact O-N 3.45Å; I120-K124 WeakPolarHBondContact O-CE 3.33Å; I120-K124 WeakPolarHBondContact O-CG 3.45Å |
| 121 | N | 87.1 | Confident | 85.8 | Confident | 106 Ų | 106 | 67.8 Ų | 67.8 | 57% | 0.567 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -82 | -40.9 | -177.3 | -76.5 | -40.6 | 0 | 0 | 0 | 113.1 | V117 F118 T119 | V117-N121 WeakPolarHBondContact O-CB 3.19Å; V117-N121 PolarHBondContact O-N 3.08Å; V117-N121 VanDerWaalsContact O-N 3.16Å; V117-N121 PolarHBondContact O-ND2 3.32Å; F118-N121 PolarHBondContact O-N 3.45Å; T119-N121 PolarHBondContact O-N 2.95Å |
| 122 | C | 85.2 | Confident | 85.7 | Confident | 64 Ų | 64 | 66.9 Ų | 66.9 | 43% | 0.432 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -92.6 | -34 | -175.8 | 171.9 | 0 | 0 | 0 | 0 | 112.9 | C64 F118 | C64-C122 WeakPolarHBondContact CA-SG 3.4Å; C64-C122 HydrophobicContact CB-CB 3.77Å; C64-C122 WeakPolarHBondContact CB-SG 3.25Å; C64-C122 VanDerWaalsContact SG-C 3.53Å; C64-C122 WeakPolarHBondContact SG-CB 3.35Å; C64-C122 CovalentContact SG-SG 2.05Å; C64-C122 PolarHBondContact SG-SG 3.45Å; F118-C122 VanDerWaalsContact O-CB 3.3Å; F118-C122 WeakPolarHBondContact O-CB 3.25Å; F118-C122 PolarHBondContact O-N 3.29Å |
| 123 | G | 67.8 | Low | 85.6 | Confident | 4 Ų | 4 | 67.5 Ų | 67.5 | 4% | 0.041 | 35% | 0.348 | C | S | . | . | trans | -95.4 | 15.1 | -167.7 | 0 | 0 | 0 | 0 | 0 | 116 | T119 L125 I126 | T119-G123 WeakPolarHBondContact O-CA 3.42Å; T119-G123 PolarHBondContact O-N 2.91Å; G123-L125 PolarHBondContact O-N 3.38Å; G123-I126 PolarHBondContact O-N 2.91Å | ||
| 124 | K | 61.4 | Low | 85.5 | Confident | 137 Ų | 137 | 67.8 Ų | 67.8 | 60% | 0.596 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.4 | -10.2 | -166.6 | -75.7 | -169.6 | 174.6 | 173.8 | 0 | 117.3 | I120 | I120-K124 WeakPolarHBondContact O-CE 3.33Å; I120-K124 WeakPolarHBondContact O-CG 3.45Å |
| 125 | L | 64.7 | Low | 85.6 | Confident | 167 Ų | 167 | 65.1 Ų | 65.1 | 87% | 0.874 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -130.3 | 1.7 | -176.2 | -80.1 | 155.4 | 0 | 0 | 0 | 114.7 | G123 | G123-L125 PolarHBondContact O-N 3.38Š|
| 126 | I | 77.8 | Confident | 85.7 | Confident | 41 Ų | 41 | 65.1 Ų | 65.1 | 21% | 0.21 | 33% | 0.334 | C | S | . | . | trans | -112.5 | 116.3 | -174.2 | -62.6 | 172.5 | 0 | 0 | 0 | 109.3 | G123 L128 Y129 Y130 | G123-I126 PolarHBondContact O-N 2.91Å; I126-L128 HydrophobicContact CG2-CB 3.83Å; I126-L128 HydrophobicContact CG2-CD1 4.3Å; I126-L128 HydrophobicContact CG2-CG 4.28Å; I126-L128 PolarHBondContact O-N 3.05Å; I126-L128 VanDerWaalsContact O-N 3.1Å; I126-Y129 HydrophobicContact CB-CD2 3.89Å; I126-Y129 HydrophobicContact CD1-CD2 4.23Å; I126-Y129 HydrophobicContact CD1-CE2 4.14Å; I126-Y129 HydrophobicContact CG2-CD2 3.99Å; I126-Y129 HydrophobicContact CG2-CE2 4.44Å; I126-Y129 PolarHBondContact O-N 3.32Å; I126-Y130 PolarHBondContact O-N 3.46Å | ||
| 127 | V | 82.3 | Confident | 85.8 | Confident | 113 Ų | 113 | 67.3 Ų | 67.3 | 69% | 0.685 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -53 | -33.2 | 179.4 | 178 | 0 | 0 | 0 | 0 | 112 | Y129 Y130 L131 | V127-Y129 VanDerWaalsContact C-N 3.35Å; V127-Y129 PolarHBondContact O-N 3.27Å; V127-Y130 WeakPolarHBondContact O-CB 3.3Å; V127-Y130 PolarHBondContact O-N 3.46Å; V127-L131 PolarHBondContact O-N 3.2Å |
| 128 | L | 82.8 | Confident | 86 | Confident | 61 Ų | 61 | 67 Ų | 67 | 32% | 0.319 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62.9 | -37.9 | 177.7 | -61 | 165.9 | 0 | 0 | 0 | 112.6 | I51 Y55 I126 Y130 L131 I132 | I51-L128 HydrophobicContact CG2-CB 3.85Å; I51-L128 HydrophobicContact CG2-CD2 3.99Å; I51-L128 HydrophobicContact CG2-CG 4.43Å; Y55-L128 HydrophobicContact CD2-CD1 3.39Å; Y55-L128 HydrophobicContact CE2-CD1 4.19Å; Y55-L128 HydrophobicContact CG-CD1 4.15Å; I126-L128 HydrophobicContact CG2-CB 3.83Å; I126-L128 HydrophobicContact CG2-CD1 4.3Å; I126-L128 HydrophobicContact CG2-CG 4.28Å; I126-L128 PolarHBondContact O-N 3.05Å; I126-L128 VanDerWaalsContact O-N 3.1Å; L128-Y130 VanDerWaalsContact C-N 3.34Å; L128-L131 WeakPolarHBondContact O-CB 3.44Å; L128-L131 PolarHBondContact O-N 2.95Å; L128-I132 PolarHBondContact O-N 2.96Å; L128-I132 VanDerWaalsContact O-N 3.09Å |
| 129 | Y | 85.9 | Confident | 86.2 | Confident | 5 Ų | 5 | 63 Ų | 63 | 2% | 0.02 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -74.5 | -25.6 | 177.3 | -74 | -58.9 | 0 | 0 | 0 | 112.6 | E52 Q63 C64 V67 T119 I126 V127 I132 T133 | E52-Y129 PolarHBondContact OE1-OH 2.9Å; Q63-Y129 HydrophobicContact CB-CE2 4.11Å; Q63-Y129 WeakPolarHBondContact CB-OH 3.25Å; Q63-Y129 PolarHBondContact O-OH 3.35Å; Q63-Y129 VanDerWaalsContact O-OH 3.08Å; C64-Y129 HydrophobicContact CB-CE1 3.85Å; C64-Y129 HydrophobicContact CB-CE2 4.22Å; C64-Y129 VanDerWaalsContact SG-CE2 3.58Å; V67-Y129 HydrophobicContact CG1-CD1 3.93Å; V67-Y129 HydrophobicContact CG1-CE1 3.74Å; T119-Y129 HydrophobicContact CG2-CD1 4.07Å; I126-Y129 HydrophobicContact CB-CD2 3.89Å; I126-Y129 HydrophobicContact CD1-CD2 4.23Å; I126-Y129 HydrophobicContact CD1-CE2 4.14Å; I126-Y129 HydrophobicContact CG2-CD2 3.99Å; I126-Y129 HydrophobicContact CG2-CE2 4.44Å; I126-Y129 PolarHBondContact O-N 3.32Å; V127-Y129 VanDerWaalsContact C-N 3.35Å; V127-Y129 PolarHBondContact O-N 3.27Å; Y129-I132 HydrophobicContact CD1-CD1 3.85Å; Y129-I132 HydrophobicContact CE1-CD1 4.01Å; Y129-T133 WeakPolarHBondContact O-CB 3.43Å; Y129-T133 PolarHBondContact O-N 3.44Å; Y129-T133 PolarHBondContact O-OG1 3.06Å |
| 130 | Y | 88.4 | Confident | 86.5 | Confident | 150 Ų | 150 | 63.5 Ų | 63.5 | 59% | 0.588 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -62.6 | -43.2 | 166.9 | -87.3 | -80.7 | 0 | 0 | 0 | 111.4 | I126 V127 L128 T133 M134 | I126-Y130 PolarHBondContact O-N 3.46Å; V127-Y130 WeakPolarHBondContact O-CB 3.3Å; V127-Y130 PolarHBondContact O-N 3.46Å; L128-Y130 VanDerWaalsContact C-N 3.34Å; Y130-T133 WeakPolarHBondContact O-CB 3.41Å; Y130-T133 PolarHBondContact O-N 3.48Å; Y130-M134 WeakPolarHBondContact O-CG 3.39Å; Y130-M134 PolarHBondContact O-N 2.9Å |
| 131 | L | 91.2 | Very high | 86.9 | Confident | 86 Ų | 86 | 64.1 Ų | 64.1 | 45% | 0.45 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.3 | -45.8 | 176.4 | -69.1 | 171.2 | 0 | 0 | 0 | 112 | I51 V127 L128 T133 M134 I135 | I51-L131 HydrophobicContact CD1-CB 3.95Å; I51-L131 HydrophobicContact CD1-CD1 4.39Å; V127-L131 PolarHBondContact O-N 3.2Å; L128-L131 WeakPolarHBondContact O-CB 3.44Å; L128-L131 PolarHBondContact O-N 2.95Å; L131-T133 VanDerWaalsContact C-N 3.27Å; L131-T133 PolarHBondContact O-N 3.32Å; L131-M134 PolarHBondContact O-N 2.72Å; L131-I135 WeakPolarHBondContact O-CG1 3.31Å; L131-I135 PolarHBondContact O-N 3.34Å |
| 132 | I | 92.4 | Very high | 87.2 | Confident | 1 Ų | 1 | 60.8 Ų | 60.8 | 1% | 0.005 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59.6 | -41.6 | 176.1 | -65.3 | 170.7 | 0 | 0 | 0 | 110.6 | I51 E52 V67 T119 L128 Y129 M134 I135 C136 | I51-I132 HydrophobicContact CG2-CD1 3.88Å; I51-I132 HydrophobicContact CG2-CG1 3.95Å; E52-I132 WeakPolarHBondContact OE2-CD1 3.41Å; V67-I132 HydrophobicContact CG1-CD1 4.43Å; V67-I132 HydrophobicContact CG1-CG2 4.18Å; T119-I132 HydrophobicContact CG2-CG2 4.13Å; L128-I132 PolarHBondContact O-N 2.96Å; L128-I132 VanDerWaalsContact O-N 3.09Å; Y129-I132 HydrophobicContact CD1-CD1 3.85Å; Y129-I132 HydrophobicContact CE1-CD1 4.01Å; I132-M134 PolarHBondContact O-N 3.21Å; I132-I135 PolarHBondContact O-N 2.95Å; I132-C136 PolarHBondContact O-N 3.49Å; I132-C136 PolarHBondContact O-SG 3.47Å |
| 133 | T | 92.9 | Very high | 87.7 | Confident | 16 Ų | 16 | 57.8 Ų | 57.8 | 10% | 0.098 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.2 | -45.7 | 177.5 | -54.1 | 0 | 0 | 0 | 0 | 111.4 | I116 T119 Y129 Y130 L131 I135 C136 I137 | I116-T133 HydrophobicContact CB-CG2 4.5Å; I116-T133 HydrophobicContact CG1-CG2 4.1Å; I116-T133 HydrophobicContact CG2-CG2 4.12Å; T119-T133 VanDerWaalsContact CB-OG1 3.24Å; T119-T133 WeakPolarHBondContact CB-OG1 3.48Å; T119-T133 PolarHBondContact OG1-OG1 3.46Å; Y129-T133 WeakPolarHBondContact O-CB 3.43Å; Y129-T133 PolarHBondContact O-N 3.44Å; Y129-T133 PolarHBondContact O-OG1 3.06Å; Y130-T133 WeakPolarHBondContact O-CB 3.41Å; Y130-T133 PolarHBondContact O-N 3.48Å; L131-T133 VanDerWaalsContact C-N 3.27Å; L131-T133 PolarHBondContact O-N 3.32Å; T133-I135 PolarHBondContact O-N 3.03Å; T133-C136 PolarHBondContact O-N 3.47Å; T133-I137 HydrophobicContact CG2-CD1 4.32Å; T133-I137 WeakPolarHBondContact O-CG1 3.33Å; T133-I137 PolarHBondContact O-N 3.47Å |
| 134 | M | 93.7 | Very high | 89 | Confident | 110 Ų | 110 | 61.8 Ų | 61.8 | 54% | 0.542 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -62.9 | -41.4 | 177.5 | -68.8 | -58.8 | -67.8 | 0 | 0 | 112 | Y130 L131 I132 I137 L138 | Y130-M134 WeakPolarHBondContact O-CG 3.39Å; Y130-M134 PolarHBondContact O-N 2.9Å; L131-M134 PolarHBondContact O-N 2.72Å; I132-M134 PolarHBondContact O-N 3.21Å; M134-I137 PolarHBondContact O-N 3.01Å; M134-I137 HydrophobicContact SD-CD1 4.44Å; M134-L138 WeakPolarHBondContact O-CG 3.39Å; M134-L138 PolarHBondContact O-N 3.01Å |
| 135 | I | 95.7 | Very high | 90.5 | Very high | 17 Ų | 17 | 58.4 Ų | 58.4 | 9% | 0.087 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.5 | -45.7 | 174.9 | -66.4 | 166.8 | 0 | 0 | 0 | 110.4 | M44 F47 C48 I51 F75 L131 I132 T133 I137 L138 V139 | M44-I135 HydrophobicContact CB-CG2 3.81Å; M44-I135 HydrophobicContact CG-CG2 4.27Å; M44-I135 HydrophobicContact SD-CG1 4.16Å; M44-I135 HydrophobicContact SD-CG2 3.91Å; F47-I135 HydrophobicContact CB-CD1 3.93Å; C48-I135 VanDerWaalsContact SG-CG2 3.53Å; I51-I135 HydrophobicContact CD1-CD1 4.04Å; F75-I135 HydrophobicContact CE2-CG2 4.13Å; L131-I135 WeakPolarHBondContact O-CG1 3.31Å; L131-I135 PolarHBondContact O-N 3.34Å; I132-I135 PolarHBondContact O-N 2.95Å; T133-I135 PolarHBondContact O-N 3.03Å; I135-I137 VanDerWaalsContact C-N 3.3Å; I135-I137 PolarHBondContact O-N 3.22Å; I135-L138 PolarHBondContact O-N 3.25Å; I135-V139 HydrophobicContact CG2-CG2 4.2Å; I135-V139 WeakPolarHBondContact O-CG2 3.41Å; I135-V139 PolarHBondContact O-N 3.01Å |
| 136 | C | 95.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.6 | -39.7 | 178.2 | -69 | 0 | 0 | 0 | 0 | 112.3 | P112 I116 I132 T133 G140 | P112-C136 HydrophobicContact CB-CB 4.02Å; I116-C136 HydrophobicContact CD1-CB 4.09Å; I116-C136 HydrophobicContact CG1-CB 3.79Å; I132-C136 PolarHBondContact O-N 3.49Å; I132-C136 PolarHBondContact O-SG 3.47Å; T133-C136 PolarHBondContact O-N 3.47Å; C136-G140 PolarHBondContact O-N 2.92Å |
| 137 | I | 96 | Very high | 92.6 | Very high | 75 Ų | 75 | 49.3 Ų | 49.3 | 39% | 0.385 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -63.7 | -46.9 | 175.6 | -66.9 | 166.8 | 0 | 0 | 0 | 110.7 | I116 T133 M134 I135 G140 L141 | I116-I137 HydrophobicContact CD1-CG1 3.67Å; I116-I137 HydrophobicContact CG1-CG1 4.38Å; T133-I137 HydrophobicContact CG2-CD1 4.32Å; T133-I137 WeakPolarHBondContact O-CG1 3.33Å; T133-I137 PolarHBondContact O-N 3.47Å; M134-I137 PolarHBondContact O-N 3.01Å; M134-I137 HydrophobicContact SD-CD1 4.44Å; I135-I137 VanDerWaalsContact C-N 3.3Å; I135-I137 PolarHBondContact O-N 3.22Å; I137-G140 PolarHBondContact O-N 2.9Å; I137-L141 HydrophobicContact CG2-CD1 4.5Å; I137-L141 WeakPolarHBondContact O-CG 3.31Å; I137-L141 PolarHBondContact O-N 3.48Å |
| 138 | L | 96.2 | Very high | 93 | Very high | 77 Ų | 77 | 50.2 Ų | 50.2 | 40% | 0.403 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -62.9 | -44.7 | 179.6 | -71.6 | 172.4 | 0 | 0 | 0 | 111.9 | M44 M134 I135 G140 L141 I142 | M44-L138 HydrophobicContact CE-CD1 4.01Å; M134-L138 WeakPolarHBondContact O-CG 3.39Å; M134-L138 PolarHBondContact O-N 3.01Å; I135-L138 PolarHBondContact O-N 3.25Å; L138-G140 VanDerWaalsContact C-N 3.31Å; L138-G140 PolarHBondContact O-N 3.44Å; L138-L141 PolarHBondContact O-N 3.27Å; L138-I142 WeakPolarHBondContact O-CG1 3.31Å; L138-I142 PolarHBondContact O-N 3.46Å |
| 139 | V | 96.2 | Very high | 93.3 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.2 | -44 | 174.6 | 171.9 | 0 | 0 | 0 | 0 | 110.5 | L41 M44 F75 I78 P112 I135 L141 I142 S143 | L41-V139 HydrophobicContact CD2-CB 4.41Å; L41-V139 HydrophobicContact CD2-CG1 3.72Å; L41-V139 HydrophobicContact CD2-CG2 4.21Å; M44-V139 HydrophobicContact CB-CG2 3.84Å; M44-V139 HydrophobicContact CG-CG2 4.2Å; F75-V139 HydrophobicContact CD1-CB 4.5Å; F75-V139 HydrophobicContact CD1-CG1 3.71Å; F75-V139 HydrophobicContact CD1-CG2 4.44Å; F75-V139 HydrophobicContact CD2-CG2 3.89Å; F75-V139 HydrophobicContact CE1-CB 4.24Å; F75-V139 HydrophobicContact CE1-CG1 3.66Å; F75-V139 HydrophobicContact CE1-CG2 4.47Å; F75-V139 HydrophobicContact CE2-CB 4.34Å; F75-V139 HydrophobicContact CE2-CG2 3.88Å; F75-V139 HydrophobicContact CG-CG1 4.23Å; F75-V139 HydrophobicContact CG-CG2 4.19Å; F75-V139 HydrophobicContact CZ-CB 4.14Å; F75-V139 HydrophobicContact CZ-CG1 4.08Å; F75-V139 HydrophobicContact CZ-CG2 4.19Å; I78-V139 HydrophobicContact CD1-CG1 4.28Å; P112-V139 HydrophobicContact CG-CG1 4.4Å; I135-V139 HydrophobicContact CG2-CG2 4.2Å; I135-V139 WeakPolarHBondContact O-CG2 3.41Å; I135-V139 PolarHBondContact O-N 3.01Å; V139-L141 VanDerWaalsContact C-N 3.31Å; V139-L141 PolarHBondContact O-N 2.94Å; V139-I142 PolarHBondContact O-N 3.18Å; V139-S143 WeakPolarHBondContact O-CB 3.12Å; V139-S143 PolarHBondContact O-N 3.4Å; V139-S143 PolarHBondContact O-OG 3.36Å |
| 140 | G | 95.1 | Very high | 93.4 | Very high | 13 Ų | 13 | 50.3 Ų | 50.3 | 13% | 0.134 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -50.3 | -49.6 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113 | G108 C136 I137 L138 I144 | G108-G140 VanDerWaalsContact O-CA 3.3Å; G108-G140 WeakPolarHBondContact O-CA 3.36Å; C136-G140 PolarHBondContact O-N 2.92Å; I137-G140 PolarHBondContact O-N 2.9Å; L138-G140 VanDerWaalsContact C-N 3.31Å; L138-G140 PolarHBondContact O-N 3.44Å; G140-I144 WeakPolarHBondContact O-CD1 3.48Å; G140-I144 WeakPolarHBondContact O-CG1 3.35Å; G140-I144 PolarHBondContact O-N 3.16Å; G140-I144 VanDerWaalsContact O-N 3.08Å |
| 141 | L | 95.6 | Very high | 93.3 | Very high | 104 Ų | 104 | 45.6 Ų | 45.6 | 55% | 0.545 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -65.4 | -46.1 | 178.8 | -65.5 | 173.5 | 0 | 0 | 0 | 112.2 | I137 L138 V139 I144 V145 | I137-L141 HydrophobicContact CG2-CD1 4.5Å; I137-L141 WeakPolarHBondContact O-CG 3.31Å; I137-L141 PolarHBondContact O-N 3.48Å; L138-L141 PolarHBondContact O-N 3.27Å; V139-L141 VanDerWaalsContact C-N 3.31Å; V139-L141 PolarHBondContact O-N 2.94Å; L141-I144 PolarHBondContact O-N 3.42Å; L141-V145 WeakPolarHBondContact O-CG2 3.42Å; L141-V145 PolarHBondContact O-N 3.02Å |
| 142 | I | 95 | Very high | 93 | Very high | 36 Ų | 36 | 47.1 Ų | 47.1 | 19% | 0.185 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.6 | -46.5 | 179.9 | -68.9 | 166.9 | 0 | 0 | 0 | 110.5 | T37 L40 L41 L138 V139 I144 V145 H146 | T37-I142 HydrophobicContact CG2-CG2 3.45Å; T37-I142 VanDerWaalsContact CG2-CG2 3.45Å; L40-I142 HydrophobicContact CB-CD1 4.3Å; L40-I142 HydrophobicContact CD1-CD1 4.29Å; L41-I142 HydrophobicContact CD2-CG2 4.11Å; L41-I142 HydrophobicContact CG-CG2 4.22Å; L138-I142 WeakPolarHBondContact O-CG1 3.31Å; L138-I142 PolarHBondContact O-N 3.46Å; V139-I142 PolarHBondContact O-N 3.18Å; I142-I144 PolarHBondContact O-N 3.39Å; I142-V145 PolarHBondContact O-N 3.14Å; I142-H146 WeakPolarHBondContact O-CB 3.31Å; I142-H146 PolarHBondContact O-N 3.01Å |
| 143 | S | 94.8 | Very high | 92.5 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -66.7 | -33.7 | -179.3 | -67.6 | 0 | 0 | 0 | 0 | 112.8 | G108 V139 T147 | G108-S143 VanDerWaalsContact CA-OG 3.28Å; G108-S143 WeakPolarHBondContact CA-OG 3.25Å; G108-S143 WeakPolarHBondContact O-CB 3.47Å; V139-S143 WeakPolarHBondContact O-CB 3.12Å; V139-S143 PolarHBondContact O-N 3.4Å; V139-S143 PolarHBondContact O-OG 3.36Å; S143-T147 VanDerWaalsContact O-CB 3.24Å; S143-T147 WeakPolarHBondContact O-CB 3.43Å; S143-T147 PolarHBondContact O-N 3.03Å; S143-T147 PolarHBondContact O-OG1 3.11Å |
| 144 | I | 95 | Very high | 92 | Very high | 89 Ų | 89 | 49 Ų | 49 | 46% | 0.456 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61.4 | -48.5 | 171.7 | -71.3 | 162.4 | 0 | 0 | 0 | 110.5 | I109 G140 L141 I142 T147 F148 | I109-I144 HydrophobicContact CD1-CG1 3.6Å; I109-I144 HydrophobicContact CG1-CG1 4.08Å; G140-I144 WeakPolarHBondContact O-CD1 3.48Å; G140-I144 WeakPolarHBondContact O-CG1 3.35Å; G140-I144 PolarHBondContact O-N 3.16Å; G140-I144 VanDerWaalsContact O-N 3.08Å; L141-I144 PolarHBondContact O-N 3.42Å; I142-I144 PolarHBondContact O-N 3.39Å; I144-T147 PolarHBondContact O-N 2.66Å; I144-F148 WeakPolarHBondContact O-CB 3.44Å; I144-F148 PolarHBondContact O-N 3.31Å |
| 145 | V | 93.7 | Very high | 91.3 | Very high | 66 Ų | 66 | 48.1 Ų | 48.1 | 40% | 0.4 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -63.8 | -46.2 | 179.6 | -179.6 | 0 | 0 | 0 | 0 | 110.1 | F33 L141 I142 T147 F148 F149 | F33-V145 HydrophobicContact CE2-CG1 3.99Å; F33-V145 HydrophobicContact CZ-CG1 3.77Å; L141-V145 WeakPolarHBondContact O-CG2 3.42Å; L141-V145 PolarHBondContact O-N 3.02Å; I142-V145 PolarHBondContact O-N 3.14Å; V145-T147 PolarHBondContact O-N 2.98Å; V145-F148 PolarHBondContact O-N 3.39Å; V145-F149 HydrophobicContact CG1-CD2 3.74Å; V145-F149 HydrophobicContact CG1-CE2 3.73Å; V145-F149 WeakPolarHBondContact O-CD2 3.19Å; V145-F149 PolarHBondContact O-N 2.92Å |
| 146 | H | 93.2 | Very high | 90.4 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -58.4 | -48.7 | 178 | -169.7 | -109.3 | 0 | 0 | 0 | 111.8 | F33 T37 D104 I142 F148 F149 V150 | F33-H146 AromaticContact CE1-CD2 3.79Å; T37-H146 HydrophobicContact CG2-CB 3.8Å; D104-H146 IonicContact OD1-ND1 3.48Å; D104-H146 IonicContact OD2-CE1 3.77Å; D104-H146 PolarHBondContact OD2-CE1 3.48Å; D104-H146 IonicContact OD2-CG 2.68Å; D104-H146 IonicContact OD2-ND1 3.79Å; D104-H146 PolarHBondContact OD2-ND1 3.03Å; I142-H146 WeakPolarHBondContact O-CB 3.31Å; I142-H146 PolarHBondContact O-N 3.01Å; H146-F148 VanDerWaalsContact C-N 3.3Å; H146-F148 PolarHBondContact O-N 3.14Å; H146-F149 PolarHBondContact O-N 3.37Å; H146-V150 WeakPolarHBondContact O-CG2 3.19Å; H146-V150 PolarHBondContact O-N 3.08Å |
| 147 | T | 92.9 | Very high | 89.2 | Confident | 16 Ų | 16 | 50.6 Ų | 50.6 | 10% | 0.098 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -56.5 | -44.6 | 177 | -61.3 | 0 | 0 | 0 | 0 | 111.7 | V101 D104 L105 S143 I144 V145 T151 | V101-T147 HydrophobicContact CG1-CG2 3.91Å; D104-T147 VanDerWaalsContact CB-OG1 3.28Å; D104-T147 WeakPolarHBondContact CB-OG1 3.35Å; L105-T147 HydrophobicContact CD2-CG2 4.18Å; L105-T147 HydrophobicContact CG-CG2 4.37Å; S143-T147 VanDerWaalsContact O-CB 3.24Å; S143-T147 WeakPolarHBondContact O-CB 3.43Å; S143-T147 PolarHBondContact O-N 3.03Å; S143-T147 PolarHBondContact O-OG1 3.11Å; I144-T147 PolarHBondContact O-N 2.66Å; V145-T147 PolarHBondContact O-N 2.98Å; T147-T151 VanDerWaalsContact O-CB 3.25Å; T147-T151 WeakPolarHBondContact O-CB 3.23Å; T147-T151 PolarHBondContact O-N 3.3Å; T147-T151 PolarHBondContact O-OG1 2.81Å |
| 148 | F | 91.4 | Very high | 88 | Confident | 133 Ų | 133 | 54 Ų | 54 | 58% | 0.583 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -61.3 | -47.5 | 179 | 177.2 | -97.9 | 0 | 0 | 0 | 111.8 | I144 V145 H146 T151 R152 | I144-F148 WeakPolarHBondContact O-CB 3.44Å; I144-F148 PolarHBondContact O-N 3.31Å; V145-F148 PolarHBondContact O-N 3.39Å; H146-F148 VanDerWaalsContact C-N 3.3Å; H146-F148 PolarHBondContact O-N 3.14Å; F148-T151 PolarHBondContact O-N 3.06Å; F148-R152 WeakPolarHBondContact O-CB 3.04Å; F148-R152 PolarHBondContact O-N 3.24Å |
| 149 | F | 88.7 | Confident | 86.7 | Confident | 67 Ų | 67 | 59.3 Ų | 59.3 | 29% | 0.294 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -67.3 | -43.9 | 179.8 | -84.4 | -82.3 | 0 | 0 | 0 | 112.4 | F33 V145 H146 T151 R152 E153 | F33-F149 HydrophobicContact CD1-CB 4.34Å; F33-F149 HydrophobicContact CD1-CG 4.5Å; F33-F149 HydrophobicContact CE1-CB 3.86Å; F33-F149 HydrophobicContact CE1-CD2 4.05Å; F33-F149 HydrophobicContact CE1-CG 4.11Å; F33-F149 HydrophobicContact CE2-CD2 4.5Å; F33-F149 AromaticContact CZ-CD2 3.96Å; F33-F149 HydrophobicContact CZ-CD2 3.96Å; F33-F149 HydrophobicContact CZ-CG 4.48Å; V145-F149 HydrophobicContact CG1-CD2 3.74Å; V145-F149 HydrophobicContact CG1-CE2 3.73Å; V145-F149 WeakPolarHBondContact O-CD2 3.19Å; V145-F149 PolarHBondContact O-N 2.92Å; H146-F149 PolarHBondContact O-N 3.37Å; F149-T151 VanDerWaalsContact C-N 3.33Å; F149-T151 PolarHBondContact O-N 3.34Å; F149-R152 WeakPolarHBondContact O-CB 2.96Å; F149-R152 PolarHBondContact O-N 3.38Å; F149-E153 PolarHBondContact O-N 2.97Å |
| 150 | V | 87.3 | Confident | 84.9 | Confident | 0 Ų | 0 | 63.2 Ų | 63.2 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -63.4 | -41.2 | 177.4 | 178.9 | 0 | 0 | 0 | 0 | 111 | L85 M97 V101 H146 R152 E153 L154 | L85-V150 HydrophobicContact CD1-CG2 4.49Å; M97-V150 HydrophobicContact CB-CG1 4.17Å; M97-V150 HydrophobicContact CE-CG1 4.1Å; V101-V150 HydrophobicContact CG2-CB 3.87Å; V101-V150 HydrophobicContact CG2-CG1 3.54Å; H146-V150 WeakPolarHBondContact O-CG2 3.19Å; H146-V150 PolarHBondContact O-N 3.08Å; V150-R152 VanDerWaalsContact C-N 3.33Å; V150-R152 PolarHBondContact O-N 3.29Å; V150-E153 PolarHBondContact O-N 3.05Å; V150-L154 PolarHBondContact O-N 2.89Å |
| 151 | T | 87 | Confident | 83.2 | Confident | 52 Ų | 52 | 70 Ų | 70 | 32% | 0.319 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -64.2 | -39.2 | 176.2 | -55.8 | 0 | 0 | 0 | 0 | 111.6 | T147 F148 F149 E153 L154 L155 | T147-T151 VanDerWaalsContact O-CB 3.25Å; T147-T151 WeakPolarHBondContact O-CB 3.23Å; T147-T151 PolarHBondContact O-N 3.3Å; T147-T151 PolarHBondContact O-OG1 2.81Å; F148-T151 PolarHBondContact O-N 3.06Å; F149-T151 VanDerWaalsContact C-N 3.33Å; F149-T151 PolarHBondContact O-N 3.34Å; T151-E153 VanDerWaalsContact C-N 3.35Å; T151-E153 PolarHBondContact O-N 3.22Å; T151-L154 WeakPolarHBondContact O-CB 3.18Å; T151-L154 PolarHBondContact O-N 3Å; T151-L155 HydrophobicContact CG2-CD1 4.48Å; T151-L155 WeakPolarHBondContact O-CG 3.36Å; T151-L155 PolarHBondContact O-N 3.49Å |
| 152 | R | 85 | Confident | 81.2 | Confident | 118 Ų | 118 | 72.7 Ų | 72.7 | 45% | 0.445 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -60.5 | -44.1 | 174.9 | -178.8 | -175.2 | 173.4 | -163 | -3.7 | 111.4 | F148 F149 V150 L155 K156 | F148-R152 WeakPolarHBondContact O-CB 3.04Å; F148-R152 PolarHBondContact O-N 3.24Å; F149-R152 WeakPolarHBondContact O-CB 2.96Å; F149-R152 PolarHBondContact O-N 3.38Å; V150-R152 VanDerWaalsContact C-N 3.33Å; V150-R152 PolarHBondContact O-N 3.29Å; R152-L155 PolarHBondContact O-N 3.42Å; R152-K156 WeakPolarHBondContact O-CG 3.45Å; R152-K156 PolarHBondContact O-N 3.35Å; R152-K156 VanDerWaalsContact O-N 3.11Å |
| 153 | E | 81.1 | Confident | 79.1 | Confident | 33 Ų | 33 | 80.3 Ų | 80.3 | 15% | 0.154 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65.8 | -40.4 | 176.4 | -65.4 | -45.1 | 127.5 | 0 | 0 | 112.1 | W30 M97 F149 V150 T151 L155 K156 L157 | W30-E153 HydrophobicContact CG-CG 4.24Å; M97-E153 HydrophobicContact CE-CB 3.67Å; F149-E153 PolarHBondContact O-N 2.97Å; V150-E153 PolarHBondContact O-N 3.05Å; T151-E153 VanDerWaalsContact C-N 3.35Å; T151-E153 PolarHBondContact O-N 3.22Å; E153-L155 VanDerWaalsContact C-N 3.33Å; E153-L155 PolarHBondContact O-N 3.15Å; E153-K156 VanDerWaalsContact CD-NZ 3.26Å; E153-K156 WeakPolarHBondContact O-CB 3.42Å; E153-K156 PolarHBondContact O-N 3.02Å; E153-K156 VanDerWaalsContact O-N 3.14Å; E153-K156 WeakPolarHBondContact OE1-CE 3.38Å; E153-K156 IonicContact OE1-NZ 2.66Å; E153-K156 PolarHBondContact OE1-NZ 3.39Å; E153-K156 VanDerWaalsContact OE2-CD 3.31Å; E153-K156 WeakPolarHBondContact OE2-CD 3.46Å; E153-K156 IonicContact OE2-NZ 3.03Å; E153-K156 PolarHBondContact OE2-NZ 3.44Å; E153-L157 PolarHBondContact O-N 3.4Å |
| 154 | L | 81.8 | Confident | 76.8 | Confident | 24 Ų | 24 | 88.4 Ų | 88.4 | 13% | 0.126 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -56.3 | -44.3 | 172 | -93.2 | 165.2 | 0 | 0 | 0 | 112.8 | A94 M97 L98 V101 V150 T151 K156 L157 R158 | A94-L154 HydrophobicContact CB-CD2 3.96Å; M97-L154 HydrophobicContact CB-CD1 3.82Å; M97-L154 HydrophobicContact CB-CD2 3.87Å; M97-L154 HydrophobicContact CB-CG 3.71Å; M97-L154 HydrophobicContact CE-CG 4.28Å; M97-L154 HydrophobicContact SD-CD2 4.28Å; M97-L154 HydrophobicContact SD-CG 4.15Å; L98-L154 HydrophobicContact CD2-CD1 3.91Å; L98-L154 HydrophobicContact CG-CD1 3.88Å; L98-L154 HydrophobicContact CG-CD2 4.17Å; V101-L154 HydrophobicContact CG2-CD1 4.36Å; V150-L154 PolarHBondContact O-N 2.89Å; T151-L154 WeakPolarHBondContact O-CB 3.18Å; T151-L154 PolarHBondContact O-N 3Å; L154-K156 VanDerWaalsContact C-N 3.31Å; L154-K156 PolarHBondContact O-N 3.39Å; L154-L157 PolarHBondContact O-N 2.84Å; L154-R158 PolarHBondContact O-N 3.38Å |
| 155 | L | 80.6 | Confident | 74.2 | Confident | 91 Ų | 91 | 90 Ų | 90 | 48% | 0.476 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -66.8 | -32.6 | 178.3 | -72.1 | 174.2 | 0 | 0 | 0 | 112.5 | T151 R152 E153 R159 | T151-L155 HydrophobicContact CG2-CD1 4.48Å; T151-L155 WeakPolarHBondContact O-CG 3.36Å; T151-L155 PolarHBondContact O-N 3.49Å; R152-L155 PolarHBondContact O-N 3.42Å; E153-L155 VanDerWaalsContact C-N 3.33Å; E153-L155 PolarHBondContact O-N 3.15Å; L155-R159 PolarHBondContact O-N 3.32Å |
| 156 | K | 75.4 | Confident | 73.2 | Confident | 45 Ų | 45 | 91.2 Ų | 91.2 | 20% | 0.196 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -66.5 | -47 | 173.9 | -73.1 | 178.4 | -170.8 | 168.9 | 0 | 111.3 | W23 R152 E153 L154 R158 R159 Q160 | W23-K156 HydrophobicContact CH2-CB 3.97Å; W23-K156 HydrophobicContact CZ2-CB 3.72Å; W23-K156 HydrophobicContact CZ2-CD 4.37Å; W23-K156 HydrophobicContact CZ2-CG 4.47Å; R152-K156 WeakPolarHBondContact O-CG 3.45Å; R152-K156 PolarHBondContact O-N 3.35Å; R152-K156 VanDerWaalsContact O-N 3.11Å; E153-K156 VanDerWaalsContact CD-NZ 3.26Å; E153-K156 WeakPolarHBondContact O-CB 3.42Å; E153-K156 PolarHBondContact O-N 3.02Å; E153-K156 VanDerWaalsContact O-N 3.14Å; E153-K156 WeakPolarHBondContact OE1-CE 3.38Å; E153-K156 IonicContact OE1-NZ 2.66Å; E153-K156 PolarHBondContact OE1-NZ 3.39Å; E153-K156 VanDerWaalsContact OE2-CD 3.31Å; E153-K156 WeakPolarHBondContact OE2-CD 3.46Å; E153-K156 IonicContact OE2-NZ 3.03Å; E153-K156 PolarHBondContact OE2-NZ 3.44Å; L154-K156 VanDerWaalsContact C-N 3.31Å; L154-K156 PolarHBondContact O-N 3.39Å; K156-R158 VanDerWaalsContact C-N 3.3Å; K156-R158 PolarHBondContact O-N 3.07Å; K156-R159 PolarHBondContact O-N 3.09Å; K156-R159 VanDerWaalsContact O-N 3.14Å; K156-Q160 PolarHBondContact O-N 3.43Å |
| 157 | L | 71.7 | Confident | 72.2 | Confident | 23 Ų | 23 | 96 Ų | 96 | 12% | 0.12 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -57.7 | -43.5 | 176.1 | -69.8 | 171.7 | 0 | 0 | 0 | 111.5 | W23 V91 M97 E153 L154 R159 Q160 F161 | W23-L157 HydrophobicContact CH2-CD2 4.26Å; W23-L157 HydrophobicContact CZ3-CD2 4.34Å; V91-L157 HydrophobicContact CG1-CD1 3.99Å; V91-L157 HydrophobicContact CG1-CD2 3.59Å; V91-L157 HydrophobicContact CG1-CG 4.45Å; M97-L157 HydrophobicContact SD-CD1 3.61Å; E153-L157 PolarHBondContact O-N 3.4Å; L154-L157 PolarHBondContact O-N 2.84Å; L157-R159 VanDerWaalsContact C-N 3.3Å; L157-R159 PolarHBondContact O-N 2.83Å; L157-Q160 WeakPolarHBondContact O-CB 3.46Å; L157-Q160 PolarHBondContact O-N 3.03Å; L157-Q160 VanDerWaalsContact O-N 3.16Å; L157-F161 WeakPolarHBondContact O-CD2 3.28Å |
| 158 | R | 71.3 | Confident | 71 | Confident | 146 Ų | 146 | 100.4 Ų | 100.4 | 55% | 0.551 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -57.6 | -41.6 | 177 | -172.6 | -179.2 | -178.7 | -152.5 | -6.8 | 112.4 | L154 K156 Q160 F161 Y162 | L154-R158 PolarHBondContact O-N 3.38Å; K156-R158 VanDerWaalsContact C-N 3.3Å; K156-R158 PolarHBondContact O-N 3.07Å; R158-Q160 VanDerWaalsContact C-N 3.25Å; R158-Q160 PolarHBondContact O-N 2.79Å; R158-F161 PolarHBondContact O-N 2.88Å; R158-Y162 HydrophobicContact CG-CD2 4.15Å; R158-Y162 HydrophobicContact CG-CE2 3.89Å; R158-Y162 PolarHBondContact NH2-OH 2.85Å; R158-Y162 WeakPolarHBondContact O-CD2 3.5Å |
| 159 | R | 67 | Low | 69.8 | Low | 190 Ų | 190 | 98.5 Ų | 98.5 | 72% | 0.717 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -66.6 | -26 | -179 | -71.9 | -177.7 | -165.5 | 179.9 | 3.7 | 113.2 | L155 K156 L157 | L155-R159 PolarHBondContact O-N 3.32Å; K156-R159 PolarHBondContact O-N 3.09Å; K156-R159 VanDerWaalsContact O-N 3.14Å; L157-R159 VanDerWaalsContact C-N 3.3Å; L157-R159 PolarHBondContact O-N 2.83Å |
| 160 | Q | 60.3 | Low | 68.6 | Low | 82 Ų | 82 | 100.5 Ų | 100.5 | 38% | 0.383 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.4 | -47 | 176.6 | -69.1 | 179 | -49.4 | 0 | 0 | 111.1 | W23 K156 L157 R158 Y162 R163 | W23-Q160 HydrophobicContact CH2-CG 4Å; W23-Q160 HydrophobicContact CZ2-CG 4.02Å; W23-Q160 VanDerWaalsContact CZ3-NE2 3.35Å; K156-Q160 PolarHBondContact O-N 3.43Å; L157-Q160 WeakPolarHBondContact O-CB 3.46Å; L157-Q160 PolarHBondContact O-N 3.03Å; L157-Q160 VanDerWaalsContact O-N 3.16Å; R158-Q160 VanDerWaalsContact C-N 3.25Å; R158-Q160 PolarHBondContact O-N 2.79Å; Q160-Y162 PolarHBondContact O-N 3.41Å; Q160-R163 PolarHBondContact O-N 2.9Å |
| 161 | F | 58 | Low | 67.4 | Low | 156 Ų | 156 | 107.2 Ų | 107.2 | 68% | 0.684 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61 | -28.8 | 178.8 | -73.9 | -72.4 | 0 | 0 | 0 | 114 | L157 R158 | L157-F161 WeakPolarHBondContact O-CD2 3.28Å; R158-F161 PolarHBondContact O-N 2.88Å |
| 162 | Y | 53.5 | Low | 66 | Low | 159 Ų | 159 | 111.1 Ų | 111.1 | 62% | 0.624 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.9 | -11.7 | 176.4 | -81.3 | -78.7 | 0 | 0 | 0 | 114.4 | R158 Q160 | R158-Y162 HydrophobicContact CG-CD2 4.15Å; R158-Y162 HydrophobicContact CG-CE2 3.89Å; R158-Y162 PolarHBondContact NH2-OH 2.85Å; R158-Y162 WeakPolarHBondContact O-CD2 3.5Å; Q160-Y162 PolarHBondContact O-N 3.41Å |
| 163 | R | 51.1 | Low | 64.5 | Low | 196 Ų | 196 | 110.6 Ų | 110.6 | 74% | 0.74 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.2 | -17.8 | 176 | -88 | -176 | 168.1 | -179.6 | -5.6 | 113.1 | Q160 | Q160-R163 PolarHBondContact O-N 2.9Š|
| 164 | E | 47.4 | Very low | 63.1 | Low | 170 Ų | 170 | 117.1 Ų | 117.1 | 79% | 0.794 | 56% | 0.557 | S | S | * | * | trans | -93.1 | -4.3 | 179.3 | -68.2 | -176.2 | 167 | 0 | 0 | 113.9 | ||||
| 165 | G | 39.7 | Very low | 61.4 | Low | 123 Ų | 123 | 125.5 Ų | 125.5 | 100% | 1.268 | 60% | 0.596 | S | S | * | * | trans | -112.8 | 0 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 |
Retrieved 165 of 165 residues in 282.2 ms
(Link to these results)